|
TCMBANKIN000094 |
choline |
Choline chloride; choline hydroxide |
C5H14NO+ |
104.17 g/mol |
C[N+](C)(C)CCO |
|
TCMBANKIN000508 |
crosatoside A |
|
C28H32O16 |
624.5 g/mol |
CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=C(C=C(C=C3)C4=C(C(=O)C5=C(C=C(C=C5O4)O)O)O)OC)CO)O)O)O)O)O |
|
TCMBANKIN001481 |
Phenylcyclopropane |
NSC 3018; Cyclopropane, phenyl-; 158011_ALDRICH; NSC3018; Benzene, cyclopropyl-; Cyclopropylbenzene; 1-Phenylcyclopropane; InChI=1/C9H10/c1-2-4-8(5-3-1)9-6-7-9/h1-5,9H,6-7H; 873-49-4; EINECS 212-839-1 |
C9H10 |
118.18 |
C1CC1C2=CC=CC=C2 |
|
TCMBANKIN001570 |
4,(3h)-quinazolinone |
|
C8H6N2O |
146.15 |
|
|
TCMBANKIN001613 |
LC 5504 |
15,16-Diepxoylabdane-14-en-7-one; 132922-55-5; Dispiro(furan-3(2H),2'(5'H)-furan-5',1''(2''H)-naphthalen)-3''(4''H)-one, 3',4',4''a,5'',6'',7'',8'',8''a-octahydro-2'',5'',5'',8''a-tetramethyl-, (1''R-(1''alpha(R*),2''alpha,4''aalpha,8''abeta))- |
C20H30O3 |
318.45 |
CC1C(=O)CC2C(CCCC2(C13CCC4(O3)COC=C4)C)(C)C |
|
TCMBANKIN001973 |
Butylbenzene |
EINECS 203-209-7; NSC 8465; HSDB 7211; N4B; 19610_FLUKA; 19600_FLUKA; 104-51-8; InChI=1/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H; 1-Butylbenzene; n-Butylbenzene; 4-05-00-01033 (Beilstein Handbook Reference); Benzene, butyl-; AI3-00119; WLN: 4R; CHEBI:44194; BRN 1903395; NSC8465; 1-Phenylbutane; B90203_ALDRICH; 74296-32-5; 47322_SUPELCO |
C10H14 |
134.22 |
CCCCC1=CC=CC=C1 |
|
TCMBANKIN002349 |
1,2-Dimethylcyclohexene |
Cyclohexene, 1,2-dimethyl- (8CI)(9CI); EINECS 216-814-6; Cyclohexene, 1,2-dimethyl-; 1674-10-8; NSC 74154; NSC74154; 58147-69-6; 1,2-Dimethyl-1-cyclohexene |
C8H14 |
110.2 g/mol |
CC1=C(CCCC1)C |
|
TCMBANKIN003068 |
(8R,9S,10R,11R,13S,14S,15S,17E)-17-ethylidene-11,15-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthrene-3,16-dione |
(8R,9S,10R,11R,13S,14S,15S,17E)-17-ethylidene-11,15-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthrene-3,16-quinone |
|
344.49 |
|
|
TCMBANKIN003219 |
ZINC00395662 |
|
C6H12O2 |
116.16 |
|
|
TCMBANKIN003341 |
NORBORNANE |
|
C7H12 |
96.17 |
C1CC2CCC1C2 |
|
TCMBANKIN003410 |
Isocoumarin |
3,4-Benzo-2-pyrone; 491-31-6; 1H-2-Benzopyran-1-one; Benzoic acid, 2-(2-hydroxyethenyl)-, delta-lactone; 1-isochromenone; isochromen-1-one |
C9H6O2 |
146.14 |
C1=CC=C2C(=C1)C=COC2=O |
|
TCMBANKIN003424 |
Dauricine (8CI) |
NSC 36413; Phenol, 4-[[(1R)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]-2-[4-[[(1R)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]-; AIDS-012035; 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]phenol; C09419; Phenol, 4-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)-2-(4-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)phenoxy)-, (R-(R*,R*))-; AIDS012035 |
C35H60O6 |
576.85 |
CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC)OC |
|
TCMBANKIN003765 |
Vilmorrianine C |
vilmorrianine c |
C35H49NO9 |
627.76 |
CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6CC4C5C6OC(=O)C7=CC=C(C=C7)OC)OC)OC(=O)C)OC)OC)COC |
|
TCMBANKIN003937 |
Placcel M |
POLYCAPROLACTONE; Hexan-6-olide; epsilon-Caprolactone; EINECS 207-938-1; E-caprolactone; 2-Oxepanone, homopolymer; 1,6-Hexanolide; c0059; 80137-66-2; ZINC00388417; C01880; CAPROLACTONE; 241296_ALDRICH; 6-Caprolactone monomer; InChI=1/C6H10O2/c7-6-4-2-1-3-5-8-6/h1-5H; epsilon-Caprolactone monomer; 52004-64-5; 6-Hexanolactone; Hexanoic acid, 6-hydroxy-, epsilon-lactone; 502-44-3; 24980-41-4; Aquaplast, caprolactone; oxepan-2-one; 1-Oxa-2-oxocycloheptane; 6-Hydroxyhexanoic acid lactone; 67184-99-0; 5-17-09-00034 (Beilstein Handbook Reference); 6-Hexanolide; HSDB 5670; hexano-6-lactone; Hexanoic acid, epsilon-lactone; 167363_ALDRICH; Hexamethylene oxide, 2-oxo-; .epsilon.-Caprolactone; 21510_FLUKA; CHEBI:17915; BRN 0106919; 2-Oxepanone; epsilon-Kaprolakton [Czech] |
C6H10O2 |
114.14 |
C1CCC(=O)OCC1 |
|
TCMBANKIN004040 |
myrtenic acid |
Myrtenate; myrtenicacid; 6,6-Dimethyl-2-norpinene-2-carboxylate; 6,6-Dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylate |
C14H28O2 |
228.37 |
CC1(C2CC=C(C1C2)C(=O)[O-])C |
|
TCMBANKIN004515 |
cis-resveratrol |
5-[(Z)-2-(4-hydroxyphenyl)vinyl]benzene-1,3-diol; (Z)-resveratrol; 5-[(Z)-2-(4-hydroxyphenyl)vinyl]resorcinol; CHEBI:36002; Tocris-1418; NCGC00024003-02; NCGC00015894-01; 5-[(1Z)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol; 5-[(Z)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol; CAS-501-36-0; NCGC00015894-02; NCGC00017352-01; Lopac-R-5010; TNP00294 |
C14H12O3 |
228.24 |
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O |
|
TCMBANKIN004644 |
4,5-Dihydrosylvan |
1487-15-6; 4,5-DIHYDRO-2-METHYLFURAN; D105805_ALDRICH; 2,3-Dihydro-5-methylfuran; 2-Methyl-4,5-dihydrofuran; Furan, 2,3-dihydro-5-methyl-; EINECS 216-067-6 |
C5H8O |
84.12 |
CC1=CCCO1 |
|
TCMBANKIN004751 |
1,3-DIMETHYLCYCLOHEXANE (TRANS) |
cyclohexane, 1,3-dimethyl-, (1R,3R)-; InChI=1/C8H16/c1-7-4-3-5-8(2)6-7/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s; (1R,3R)-1,3-dimethylcyclohexane |
C8H16 |
112.21 |
CC1CCCC(C1)C |
|
TCMBANKIN004943 |
Epibetulinic acid |
AIDS-107572; 3-Hydroxylup-20(29)-en-28-oic acid,(3.alpha.); AIDS107572 |
C30H48O3 |
456.7 |
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O |
|
TCMBANKIN004992 |
p-Amino-o-cresol |
4-amino-2-methyl-phenol; ZINC01669677; 4-amino-2-methylphenol; 2835-96-3; 4-Amino-o-cresol; EINECS 220-619-1; 225053_ALDRICH; Phenol, 4-amino-2-methyl-; o-Cresol, 4-amino-; InChI=1/C7H9NO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,8H2,1H |
C7H9NO |
123.15 |
CC1=C(C=CC(=C1)N)O |
|
TCMBANKIN005290 |
(2S,3R,4S,5S,6R)-2-(4-hydroxy-3-methyl-phenoxy)-6-methylol-tetrahydropyran-3,4,5-triol |
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-3-methylphenoxy)oxane-3,4,5-triol; (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-3-methyl-phenoxy)oxane-3,4,5-triol; (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-3-methyl-phenoxy)tetrahydropyran-3,4,5-triol; (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-3-methylphenoxy)tetrahydropyran-3,4,5-triol |
C13H18O7 |
286.28 |
CC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)O)O |
|
TCMBANKIN005454 |
α-turmerone |
|
C15H22O |
218.33 |
|
|
TCMBANKIN005553 |
2 - methyl - 3 - (2 - propenyl) - phenol |
|
|
148.22 |
|
|
TCMBANKIN005872 |
ALLYLBENZENE |
2-Propenylbenzene; Allylbenzene; 57807-91-7; EINECS 206-095-7; 300-57-2; 3-Phenyl-1-propene; Benzene, propenyl-; A29402_ALDRICH; 4-05-00-01362 (Beilstein Handbook Reference); InChI=1/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-5,7-8H,1,6H; 128961-80-8; 05840_FLUKA; ZINC01561526; 1-Benzylethene; NSC 18609; Benzene, allyl-; NSC18609; WLN: 1U2R; 1-Phenyl-2-propene; BRN 1098501; prop-2-enylbenzene; 3-Phenylpropene; Benzene, 2-propenyl-; 1-Propene, 3-phenyl- |
C9H10 |
118.18 |
C=CCC1=CC=CC=C1 |
|
TCMBANKIN006112 |
(3S,3aS,8aR)-3-hydroxy-5-isopropylidene-3-methyl-8-methylene-2,3a,4,8a-tetrahydro-1H-azulen-6-one |
(3S,3aS,8aR)-3-hydroxy-3-methyl-8-methylidene-5-propan-2-ylidene-2,3a,4,8a-tetrahydro-1H-azulen-6-one |
C15H22O2 |
234.33 |
|
|
TCMBANKIN006243 |
3,3-Dimethylbutylamine |
3,3-DIMETHYLBUTANAMINE; EINECS 223-353-4; 59367-75-8; 15673-00-4; 3,3-dimethylbutan-1-amine; 1-butanamine, 3,3-dimethyl-; 1,2,2-Trimethylpropylamine; EINECS 239-749-5; 183113_ALDRICH; InChI=1/C6H15N/c1-6(2,3)4-5-7/h4-5,7H2,1-3H |
C6H15N |
101.19 |
CC(C)(C)CCN |
|
TCMBANKIN006316 |
(R)-2-butanol |
(-)-2-butanol; 14898-79-4; (R)-Butan-2-ol; (R)-(−)-sec-Butyl alcohol; (2R)-butan-2-ol; (R)-(-)-sec-butyl alcohol; (R)-(-)-2-butanol; CHEBI:35686; 236691_ALDRICH; EINECS 238-967-8; ZINC01622055; (R)-(−)-2-Butanol |
C4H10O |
74.12 |
CCC(C)O |
|
TCMBANKIN006472 |
(3R,5S)-3,5-dimethyltetrahydrofuran-2-one |
(3R,5S)-3,5-dimethyloxolan-2-one; (3R,5S)-3,5-dimethyl-2-tetrahydrofuranone; InChI=1/C6H10O2/c1-4-3-5(2)8-6(4)7/h4-5H,3H2,1-2H3/t4-,5+/m1/s |
C6H10O2 |
114.14 g/mol |
CC1CC(OC1=O)C |
|
TCMBANKIN006943 |
histamine |
beta-Aminoethylglyoxaline; 3bu1; IDI1_002144; Bio1_000976; AIDS020252; Histamium; 2-(3H-imidazol-4-yl)ethanamine; Bio1_000487; 5-Imidazoleethylamine; 4-Imidazoleethylamine; NCGC00093371-03; Spectrum3_000452; BCBcMAP01_000250; KBio3_000854; L-histamine; 1H-Imidazole-4-ethanamine; Spectrum4_000960; BSPBio_001117; KBio2_003893; C00388; 2-(1H-imidazol-4-yl)ethanamine; KBio2_000457; KBioSS_000457; Histamine, Free Base; CCRIS 6535; SMR000059091; NSC33792; KBio2_003025; CHEBI:58432; 2-(4-Imidazolyl)ethylamine; BSPBio_002124; Istamina [Italian]; Ergamine; 2-(1H-imidazol-5-yl)ethylazanium; ZERO/004089; HSM; 4-(2-Aminoethyl)-1H-imidazole; Eramin; Spectrum_000845; CJ-15872; Histamine Base; histaminium; .beta.-Imidazolyl-4-ethylamine; histaminium cation; Bio1_001465; beta-Imidazolyl-4-ethylamine; NSC 33792; KBioGR_001580; 3rxh; SMP1_000151; WLN: T5M CNJ D2Z; Histamine [USAN]; Imidazole-4-ethylamine; beta-Aminoethylimidazole; Spectrum2_000665; KBioSS_001325; Ergotidine; KBio3_000853; 2-Imidazol-4-ylethylamine; SDCCGMLS-0066601.P001; 5-(2-Aminioethyl)-1H-imidazole; 2-(3H-imidazol-4-yl)ethylamine; peremin; A828600; 51-45-6; AIDS-020252; HSDB 3338; NCGC00015513-01; HISTAMINE; EINECS 200-100-6; KBio2_005593; Lopac0_000595; nchembio714-comp1; KBio1_000308; MLS000069447; CHEBI:18295; Lopac-H-7250; Ethylamine, 2-imidazol-4-yl-; KBio3_001344; Free histamine; IDI1_000308; H7125_SIGMA; 2-(1H-imidazol-4-yl)ethanaminium; KBioGR_000457; KBio2_006461; ST073926; 53290_FLUKA; FT-0669215; 2-(1H-imidazol-5-yl)ethylammonium; beta-aminothethylglyoxaline; Bio2_000389; Spectrum5_000796; SPBio_000729; Theramine; DivK1c_000308; KBio2_001325; NINDS_000308; NCGC00093371-04; Bio2_000869; Imidazole, 4-(2-aminoethyl)-; 2-(1H-imidazol-5-yl)ethanamine |
C5H9N3 |
111.15 |
C1=C(NC=N1)CCN |
|
TCMBANKIN007332 |
2-Methylbenzoxazol |
AIDS-019654; Usaf ek-982; 2-Methylbenzoxazol [Czech]; ZINC00388067; NSC3824; 95-21-6; InChI=1/C8H7NO/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,1H; EINECS 202-399-9; AIDS019654; 65880_FLUKA; 2-methyl-1,3-benzoxazole; 2-Methylbenzoxazole; NSC 3824; 108936_ALDRICH; Benzoxazole, 2-methyl-; WLN: T56 BN DOJ C1 |
C8H7NO |
133.15 |
CC1=NC2=CC=CC=C2O1 |
|
TCMBANKIN007403 |
()-Styrene glycol |
(S)-()-Phenylethylene glycol; InChI=1/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H; (1S)-1-phenylethane-1,2-diol; (S)-()-1-Phenyl-1,2-ethanediol; ZINC00391852; 302155_ALDRICH; TE5119; 1-phenylethane-1,2-diol |
C8H10O2 |
138.16 |
C1=CC=C(C=C1)C(CO)O |
|
TCMBANKIN007494 |
METHYLCYCLOHEXENE |
.alpha.-Methylcyclohexene; 1-Methyl-1-cyclohexene; InChI=1/C7H12/c1-7-5-3-2-4-6-7/h5H,2-4,6H2,1H; 2,3,4,5-Tetrahydrotoluene; 129801_ALDRICH; Cyclohexene, methyl-; Cyclohexene, 1-methyl-; NSC 66539; AI3-52478; 1-Methylcyclohexene; 1335-86-0; NSC66539; 591-49-1; ghl.PD_Mitscher_leg0.949; EINECS 215-640-8; alpha-Methylcyclohexene; EINECS 209-718-0; 66430_FLUKA |
C7H12 |
96.17 |
CC1=CCCCC1 |
|
TCMBANKIN007531 |
(2R,3R)-3-hydroxyproline |
(2R,3R)-3-hydroxypyrrolidine-2-carboxylic acid; (2R,3R)-3-hydroxy-2-pyrrolidinecarboxylic acid |
C5H9NO3 |
131.13 |
C1CNC(C1O)C(=O)O |
|
TCMBANKIN007765 |
GRO |
(R)-(−)-2-Phenylpropionic acid; (2R)-2-phenylpropionic acid; (R)-HTA; (R)-(−)-Hydratropic acid; (2R)-2-phenylpropanoic acid; 279897_ALDRICH; R-2-PHENYL-PROPRIONIC ACID |
C9H10O2 |
150.17 |
CC(C1=CC=CC=C1)C(=O)O |
|
TCMBANKIN007791 |
2-Propylfuran |
Furan, 2-propyl-; EINECS 224-182-8; AI3-26552; 4229-91-8; NSC35553; ZINC01668229 |
C7H10O |
110.15 |
CCCC1=CC=CO1 |
|
TCMBANKIN008005 |
Imidazole, 2-acetoxy- |
1H-imidazol-2-yl ethanoate; 1H-imidazol-2-yl acetate; acetic acid 1H-imidazol-2-yl ester |
C5H6N2O2 |
126.11 g/mol |
CC(=O)OC1=NC=CN1 |
|
TCMBANKIN008160 |
TERT-BUTYLTOLUENE |
1-Methyl-2-tert-butylbenzene; 1-tert-Butyl-2-methylbenzene; 27138-21-2; NSC23694; 1074-92-6; o-tert-Butyltoluene; 2-tert-Butyltoluene; Benzene, (1,1-dimethylethyl)methyl-; Toluene, o-tert-butyl-; (1,1-Dimethylethyl)methylbenzene; Benzene, 1-(1,1-dimethylethyl)-2-methyl-; 1-tert-butyl-2-methyl-benzene |
C11H16 |
148.24 |
CC1=CC=CC=C1C(C)(C)C |
|
TCMBANKIN008324 |
Pentanol-3 |
76950_FLUKA; 584-02-1; NSC8654; ZINC01648159; sec-inact.-Pentyl alcohol; Pentan-3-ol; 3-Pentanol; BRN 1730964; AI3-24335; 76948_FLUKA; Diethyl carbinol; WLN: QY2&2; sec-Pentanol; NSC 8654; 4-01-00-01662 (Beilstein Handbook Reference); 3-Pentyl alcohol; P8025_ALDRICH; EINECS 209-526-7 |
C5H12O |
88.15 |
CCC(CC)O |
|
TCMBANKIN008602 |
Cholanoic acid |
5.beta.-Cholanic acid; CHEBI:36238; Cholan-24-oic acid, (5beta)- (9CI); LMST04010441; Cholan-24-oic acid, (5.beta.)-; (4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid; NSC18161; (4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; Ursocholanic acid; 5beta-Cholanoic acid; 5beta-Cholan-24-oic acid (8CI); NSC 18161; Androstane-17-butanoic acid, gamma-methyl-, (5beta,17beta)-; 5beta-Cholan-24-oic Acid; 5.beta.-Cholan-24-oic acid; L 596205-0; 5beta-Cholanic acid; Androstane-17-butanoic acid, .gamma.-methyl-, (5.beta.,17.beta.)-; (5beta)-cholan-24-oic acid; 546-18-9; 5.beta.-Cholanoic acid; (5beta,17beta)-gamma-methylandrostane-17-butanoic acid |
C24H40O2 |
360.57 |
CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C |
|
TCMBANKIN008710 |
4-[(3R)-3-hydroxybutyl]phenol |
ZINC00506564 |
C10H14O2 |
166.22 |
CC(CCC1=CC=C(C=C1)O)O |
|
TCMBANKIN008919 |
isoguvacine |
MLS000859962; Isoguvacine hydrochloride, solid; I02-4338; SR-01000075611-3; 1,2,3,6-tetrahydro-4-pyridinecarboxylicacidhydrochloride; Lopac-G-002; G-002; SY012592; KBio1_000115; SMR000326821; 1,2,3,6-tetrahydropyridine-4-carboxylic acid; IDI1_000115; NCGC00093946-02; 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acid hydrochloride; Tocris-0235; EU-0100561; Isoguvacine (hydrochloride); ISOGUVACINE HYDROCHLORIDE; NINDS_000115; 68547-97-7; SUWREQRNTXCCBL-UHFFFAOYSA-N; HY-100810; NCGC00024509-03; NCGC00093946-03; NCGC00015456-01; SCHEMBL7958625; TRA0081918; B6230; 1,2,3,6-Tetrahydro-4-pyridinecarboxylic acid hydrochloride; MFCD00055192; NCGC00024509-01; TR-022104; SPECTRUM1502129; Biomol-NT_000254; Isoguvacine; LP00561; SR-01000075611; KBio3_002820; FT-0670465; I0871; Spectrum_001974; SC-49605; C13694; AX8223448; 4-Pyridinecarboxylic acid, 1,2,3,6-tetrahydro-, hydrochloride; AKOS025243370; BPBio1_000882; 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acid hydr; KBio2_007667; 4-Pyridinecarboxylic acid, 1,2,3,6-tetrahydro-; KS-00000AIF; MolPort-003-983-601; CCG-221865; BSPBio_003318; 1,2,3,6-Tetrahydro-4-pyridinecarboxylic acid; Lopac0_000561; AKOS015847455; NCGC00093946-01; 64603-90-3 (Parent); AK154352; 1,2,3,6-TETRAHYDRO-4-PYRIDINECARBOXYLIC ACID HCL; 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acidhydrochloride; Tox21_500561; BN0277; KBio2_002531; SC-49604; AC1L4DMR; 1,2,3,6-tetrahydropyridine-4-carboxylic acid hydrochloride; CS-6967; SR-01000075611-1; DTXSID00218663; 1,2,5,6,-Tetrahydroisonicotinic acid Hydrochloride; KBioSS_002540; KBio2_005099; CHEMBL540303; Spectrum3_001869; Z-2044; NCGC00261246-01; DivK1c_000115; Isoguvacine HCl; 1,2,5,6-tetrahydroisonicotinic acid hydrochloride |
C6H9NO2 |
127.14 |
C1CNCC=C1C(=O)O |
|
TCMBANKIN009004 |
4-[(1S)-1-hydroxy-2-methylaminoethyl]phenol |
CHEBI:33016; 4-[(1S)-1-hydroxy-2-methylamino-ethyl]phenol; (+)-p-hydroxy-alpha-[(methylamino)methyl]benzyl alcohol; (S)-4-hydroxy-alpha-[(methylamino)methyl]benzenemethanol; InChI=1/C9H13NO2/c1-10-6-9(12)7-2-4-8(11)5-3-7/h2-5,9-12H,6H2,1H; 4-[(1S)-1-hydroxy-2-(methylamino)ethyl]phenol |
C9H13NO2 |
167.21 |
CNCC(C1=CC=C(C=C1)O)O |
|
TCMBANKIN009064 |
PHA |
alpha-Aminohydrocinnamic acid, L-; C00079; NSC-9959; nchembio816-comp8; NCGC00013103; P2126_SIAL; beta-phenylalanine; FEMA No. 3585; Phenylalaninum [Latin]; NSC 79477; (S)-2-Amino-3-phenylpropanoic acid; (S)-2-Amino-3-phenylpropionic acid; L-Alanine, 3-phenyl-; NCGC00095047-01; (L)-Phenylalanine; Phenylalanine (VAN); (S)-alpha-Aminohydrocinnamic acid; alpha-Amino-beta-phenylpropionic acid, L-; (S)-alpha-Amino-benzenepropanoic acid; NCIStruc1_000204; Phenylalanine [USAN:INN:JAN]; Phenylalanine (USP/INN); 2-Amino-3-phenylpropionic acid, L-; NCI9959; MTY; 67675-33-6; EINECS 200-568-1; alpha-aminohydrocinnamic acid; (2S)-2-amino-3-phenyl-propionic acid; L-Phenylalanine (JP15); W358509_ALDRICH; Fenilalanina [Spanish]; CCRIS 6767; CHEBI:17295; (2S)-2-amino-3-phenylpropanoic acid; L-PHENYLALININE; NCGC00095047-02; Benzenepropanoic acid, alpha-amino-, (S)-; beta-Phenylalnine, (-)-; Hydrocinnamic acid, alpha-amino-; P8740_SIAL; 10549-09-4; (2S)-2-amino-3-phenyl-propanoic acid; 5297-02-9; P5482_SIGMA; LS-1515; (S)-(-)-Phenylalanine; (S)-alpha-Amino-beta-phenylpropionic acid; HSDB 1825; NCIStruc2_000248; beta-Phenyl-L-alanine; ST5406159; D00021; 78019_FLUKA; Phenylalanine, L-; NCGC00095047-04 |
C35H36N4O5 |
592.7 g/mol |
CCC1=C(C2=NC1=CC3=C(C4=C(N3)C(=C5C(C(C(=CC6=NC(=C2)C(=C6C)C=C)N5)C)CCC(=O)O)C(=C4O)C(=O)OC)C)C |
|
TCMBANKIN009086 |
(7S,8S,9S,10R,13S,14S,17R)-17-ethyl-7-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-3,16-dione |
(7S,8S,9S,10R,13S,14S,17R)-17-ethyl-7-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,17-decahydro-1H-cyclopenta[a]phenanthrene-3,16-quinone |
|
330.51 |
|
|
TCMBANKIN009126 |
D-Prolin |
AI3-26710; NCGC00163339-02; FEMA No. 3319; InChI=1/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8; C00763; Proline [USAN:INN]; L-Pyrrolidine-2-carboxylic acid; (R)-pyrrolidine-2-carboxylic acid; NCI97923; NCIStruc2_000132; NCGC00163339-01; (S)-2-Pyrrolidinecarboxylic acid; Prolinum [Latin]; EINECS 205-702-2; HSDB 1210; (-)-2-Pyrrolidinecarboxylic acid; 858919_ALDRICH; (2R)-2-pyrrolidinecarboxylic acid; (2R)-pyrrolidine-2-carboxylic acid; PRO (IUPAC abbreviation); 81705_FLUKA; CB 1707; (2R)-proline; Proline (VAN); 7005-20-1; SBB006712; PROLINE (L); L-alpha-Pyrrolidinecarboxylic acid; CHEBI:16313; EINECS 206-452-7; Prolina [Spanish]; (L)-PROLINE; FEMA Number 3319; NSC 46703; NCIStruc1_001918 |
C5H9NO2 |
115.13 |
CC(C)(C)OC1=CC=C(C=C1)CC(C(=O)O)NC(=O)OC(C)(C)C |
|
TCMBANKIN009345 |
chrysin-7-O-glucuronide |
|
C21H18O10 |
430.36 |
C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O |
|
TCMBANKIN010129 |
1-PHENYL-ETHANOL |
(R)-alpha-methylbenzenemethanol; P4277_SIGMA; 07366_FLUKA; SS2; (1R)-1-PHENYLETHANOL; (R)-()-1-Phenylethanol; 77848_FLUKA; ST5411712; (R)-1-phenylethanol; ()-Methyl phenyl carbinol; ZINC00896626; (R)-()-alpha-Methylbenzyl alcohol; InChI=1/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H; CHEBI:45616 |
C8H10O |
122.16 |
CC(C1=CC=CC=C1)O |
|
TCMBANKIN010208 |
(1S,2S)-1,2-bis(2-furyl)ethane-1,2-diol |
(1S,2S)-1,2-di(furan-2-yl)ethane-1,2-diol |
C5H6O2 |
98.1 |
|
|
TCMBANKIN010282 |
MEHQ |
1-Hydroxy-4-methoxybenzene; p-Guaiacol; Novo-Dermoquinona; EINECS 205-769-8; WLN: QR DO1; Mequinol [DCF:INN]; p-Methoxyphenol; Leucobasal; 4-Hydroxyphenol, polymer-bound; Hydroquinone monomethyl ether; PHENOL,4-METHOXY; Phenol, 4-methoxy-; Mono methyl ether hydroquinone; 4-Methoxyphenol; Mequinol (USAN); InChI=1/C7H8O2/c1-9-7-4-2-6(8)3-5-7/h2-5,8H,1H; M18655_ALDRICH; HQMME; Mequinol; CCRIS 5531; Mequinolum [INN-Latin]; Monomethyl ether hydroquinone; Mechinolo [DCIT]; 54050_FLUKA; 650382_ALDRICH; HSDB 4258; 4-Hydroxyanisole; NSC 4960; Mechinolum; p-Hydroxyanisole; Leucodine B; AI3-00841; NCGC00091390-01; PMF (antioxidant); p-Hydroxymethoxybenzene; Usaf an-7; 150-76-5; SB 01123; BMS 181158; ZINC00001684; NSC4960; NCI60_004190; D04926; Hydroquinone methyl ether; Phenol, p-methoxy-; NCIMech_000709 |
C7H8O2 |
124.14 |
COC1=CC=C(C=C1)O |
|
TCMBANKIN010796 |
4,7-Dimethylindan |
4,7-dimethylindane; 6682-71-9; NSC81389; Indan, 4,7-dimethyl-; 4,7-dimethyl-2,3-dihydro-1H-indene; 1H-Indene, 2,3-dihydro-4,7-dimethyl-; 4,7-Dimethyl-[2,3-dihydroindene]; 2,3-Dihydro-4,7-dimethyl-1H-indene; InChI=1/C11H14/c1-8-6-7-9(2)11-5-3-4-10(8)11/h6-7H,3-5H2,1-2H |
C11H14 |
146.23 |
CC1=C2CCCC2=C(C=C1)C |
|
TCMBANKIN011279 |
p-Methylcinnamic acid |
3-(4-methylphenyl)acrylic acid; 3-(4-METHYLPHENYL)-2-PROPENOIC ACID; ARONIS003023; (E)-3-(4-methylphenyl)prop-2-enoic acid; M35800_ALDRICH; Enamine_005062; NCIOpen2_001890; 1866-39-3; 4-Methylcinnamic acid, predominantly trans; 4-Methylcinnamic acid; NSC66272; (E)-3-(4-methylphenyl)acrylic acid; M105; NSC98545; NSC 66272; NSC98546; 3-(4-methylphenyl)prop-2-enoic acid; EINECS 217-479-9; SBB015822; trans-p-Methylcinnamic acid; IDI1_007649 |
C10H10O2 |
162.19 |
CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C#N)C(=O)O |
|
TCMBANKIN011519 |
(1S,2S)-1,2-dimethylcyclopentane |
cyclopentane, 1,2-dimethyl-, (1S,2S)-; InChI=1/C7H14/c1-6-4-3-5-7(6)2/h6-7H,3-5H2,1-2H3/t6-,7-/m0/s |
C7H14 |
98.19 |
CC1CCCC1C |
|
TCMBANKIN012472 |
p-Allyltoluene |
1-methyl-4-prop-2-enyl-benzene; 1-Allyl-4-methylbenzene; EINECS 222-063-5; 4-Allyltoluene; Toluene, p-allyl-; 3333-13-9; 4-Isopropenyltoluene; 3-p-Tolylpropene; Benzene, 1-methyl-4-(2-propenyl)-; p-Methylallylbenzene; 1-allyl-4-methyl-benzene; Toluene, p-allyl- (8CI); NSC 73971; NSC73971; 1-methyl-4-prop-2-enylbenzene |
C10H12 |
132.2 |
CC1=CC=C(C=C1)CC=C |
|
TCMBANKIN012675 |
arjunetin |
|
C36H58O10 |
650.84 |
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)CO)C)C2C1)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O)C |
|
TCMBANKIN012686 |
o-Anisaldehyde |
ZINC01090557; BRN 0606301; 2-Anisaldehyde; NSC58960; ST5213390; Benzaldehyde, 2-methoxy-; AI3-01375; EINECS 205-171-7; 4-08-00-00180 (Beilstein Handbook Reference); 109622_ALDRICH; Formylanisole, o-; 2-Methoxybenzaldehyde; 64770_FLUKA; 135-02-4; o-Methoxybenzaldehyde; NSC 58960; 2-Methoxyphenylformaldehyde; InChI=1/C8H8O2/c1-10-8-5-3-2-4-7(8)6-9/h2-6H,1H; 6-Methoxybenzaldehyde; 2-Methoxybenzenecarboxaldehyde; Salicylaldehyde methyl ether; Benzaldehyde, o-methoxy- |
C8H8O2 |
136.15 |
COC1=CC=CC=C1C=O |
|
TCMBANKIN012762 |
3-Methylpentane |
96-14-0; NSC 66497; 68320_FLUKA; NSC66497; InChI=1/C6H14/c1-4-6(3)5-2/h6H,4-5H2,1-3H; M66005_ALDRICH; 442390_SUPELCO; Pentane, 3-methyl-; 3-methylpentane; AI3-28852; EINECS 202-481-4; HSDB 5300; 68322_FLUKA; Diethylmethylmethane |
C6H14 |
86.18 |
CCC(C)CC |
|
TCMBANKIN012964 |
COLLIDINE |
AO-801/41077394; NSC76593; Pyridine, trimethyl-; NSC 76593; Pyridine, 2,3,6-trimethyl-; 29611-84-5; Trimethylpyridine; 1462-84-6; ZINC00967173; 2,3,6-Collidine; 2,3,6-Trimethylpyridine; EINECS 215-970-2 |
C8H11N |
121.18 g/mol |
CC1=C(N=C(C=C1)C)C |
|
TCMBANKIN012976 |
d-mandelonitrile |
(2R)-hydroxy(phenyl)acetonitrile; (R)-mandelonitrile; (2R)-2-hydroxy-2-phenylacetonitrile; (2R)-2-hydroxy-2-phenyl-acetonitrile; (2R)-2-hydroxy-2-phenyl-ethanenitrile; 469653_ALDRICH; CHEBI:18450; (R)-(+)-mandelonitrile; (+)-mandelonitrile; (R)-()-alpha-Hydroxybenzeneacetonitrile; (R)-()-Mandelonitrile |
C20H27NO11 |
457.43 |
C1=CC=C(C=C1)C(C#N)O |
|
TCMBANKIN012984 |
1,2,3-Trimethylcyclopentene |
|
C8H14 |
110.2 g/mol |
CC1CCC(=C1C)C |
|
TCMBANKIN012991 |
1-Butyl-4-methoxybenzene |
1-butyl-4-methoxy-benzene; Benzene, 1-butyl-4-methoxy-; 18272-84-9; NSC31625 |
C11H16O |
164.24 |
CCCCC1=CC=C(C=C1)OC |
|
TCMBANKIN013387 |
guvacine |
BN0243; Lopac-G-007; Lopac0_000571; 1,2,5,6-Tetrahydro-3-pyridinecarboxylic acid; EU-0100571; 1,2,5,6-tetrahydropyridine-3-carboxylic acid hydrochloride; Guvacine; SCHEMBL1057880; NCGC00015457-01; DivK1c_006904; MLS000859975; CCG-38871; KBio2_004474; Tox21_500571; MFCD00055191; BPBio1_000838; FT-0669083; SR-01000075614-1; 498-96-4; Spectrum4_001753; EN000938; Tocris-0234; AK-82183; AKOS025243938; NCGC00261256-01; MCULE-9382105537; LP00571; 1,2,5,6-Terahydropyridine-3-carboxylic acid hydrochloride; NCGC00024508-01; Guvacine hydrochloride, >=97% (NMR), solid; FGNUNVVTHHKDAM-UHFFFAOYSA-N; 1,2,5,6-Tetrahydronicotinic acid hydrochloride; KBio2_001906; TR-020835; NCGC00093955-03; ACM498964; 1,2,5,6-tetrahydropyridine-3-carboxylic acid; 8985AB; Spectrum_001426; Spectrum5_000606; SMR000326834; SPECTRUM1502126; G-007; Spectrum3_001511; SR-01000075614-3; ZX-CM014693; SR-01000075614-6; MolPort-003-665-602; KBioGR_002226; CHEMBL1256362; 1,2,5,6-Tetrahydronicotinic acid; B6229; Guvacine hydrochloride; KBioSS_001906; Guvacine HCl; SPBio_001427; ANW-67778; TRA0072680; KB-123426; Biomol-NT_000253; Y1163; SR-01000075614; NCGC00093955-01; 1,2,5,6-tetrahydro-3-pyridinecarboxylic acid, hydrochloride salt; 3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-; Spectrum2_001474; NCGC00024508-03; Ambcb4141599; SDCCGMLS-0066665.P001; KBio1_001848; 6027-91-4; BSPBio_003181; AX8236874; SpecPlus_000808; C10149; NCGC00093955-02; GUVACINE HYDROCHLORIDE >96% \ GABA UPTAK; KBio3_002681; KBio2_007042; Z-2043; 1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid hydrochloride; AKOS015849631; CTK7I6002 |
C6H9NO2 |
127.14 |
C1CNCC(=C1)C(=O)O |
|
TCMBANKIN013889 |
Tetranap |
EINECS 204-340-2; WLN: L66 & TJ; InChI=1/C10H12/c1-2-6-10-8-4-3-7-9(10)5-1/h1-2,5-6H,3-4,7-8H; CHEBI:35008; 119-64-2; 522651_ALDRICH; delta(sup 5,7,9)-naphthantriene; NSC 77451; NCGC00091744-01; Bacticin; Tetralin; Naphthalene 1,2,3,4-tetrahydride; 456438_ALDRICH; CCRIS 3564; EINECS 270-178-4; Tetraline; AI3-01257; Caswell No. 842A; tetralene; HSDB 127; 1,2,3,4-Tetrahydronaphthalene; (C4-C5) Alkyltetrahydronaphthalenes; .delta.(sup 5,7,9)-Naphthantriene; Naphthalene, 1,2,3,4-tetrahydro-; EPA Pesticide Chemical Code 055901; c0986; Tetralin solvent; 429325_ALDRICH; Benzocyclohexane; 95462_FLUKA; Tetralina; C14114; 68412-24-8; Tetralina [Polish]; NSC77451; NCIOpen2_000650; Naphthalene, 1,2,3,4-tetrahydro-, C1-4-alkyl derivs.; Tetrahydronaphthalene |
C10H12 |
132.2 |
C1CCC2=CC=CC=C2C1 |
|
TCMBANKIN014100 |
o-Anisic acid |
Salicylic acid methyl ether; O-Methoxy benzoic acid; 2-Anisic acid; TimTec1_004173; 64790_FLUKA; BRN 0509929; 2-Methoxybenzoic acid; 4-10-00-00130 (Beilstein Handbook Reference); EINECS 209-447-8; Kyselina 2-methoxybenzoova [Czech]; InChI=1/C8H8O3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H,9,10; 169978_ALDRICH; ST5213887; Benzoic acid, 2-methoxy-; O-Methylsalicylic acid; AI3-20226; BENZOIC ACID,2-METHOXY; 579-75-9; NSC3778; NSC 3778; W394300_ALDRICH; AIDS018079; o-Methoxybenzoic acid; AIDS-018079 |
C8H8O3 |
152.15 |
COC1=CC=CC=C1C(=O)O |
|
TCMBANKIN014477 |
Phenylpropynoic acid |
637-44-5; Propiolic acid, phenyl-; NSC 13669; NSC13669; 2-Propynoic acid, 3-phenyl-; AD-266/40164861; ST5208978; Propiolic acid, phenyl- (8CI); Phenylacetylene monocarboxylic acid; 3-Phenylpropiolic acid; Propiolic acid, 3-phenyl-; EINECS 211-285-8; 3-phenylprop-2-ynoic acid; 78982_FLUKA; AI3-17875; Phenylpropiolic acid; 3-Phenylpropynoic acid; P31205_ALDRICH; Phenylacetylenecarboxylic acid |
C9H6O2 |
146.14 |
C1=CC=C(C=C1)C#CC(=O)O |
|
TCMBANKIN014755 |
2-Pyridylamine |
36685_RIEDEL; AC-907/25014346; SBB004394; 29212-31-5; alpha-Aminopyridine; HSDB 2068; Amino-2 pyridine; 2-Aminopyridine; 2-Aminopryidine; CCRIS 4747; o-Aminopyridine [UN2671] [Poison]; Pyridine, 2-amino-; NSC431; 102769-74-4; .beta.-Pyridylamine; o-Aminopyridine; 504-29-0; NSC 431; .alpha.-Pyridinamine; 24843-39-8; A77997_ALDRICH; alpha-Pyridylamine; 26445-05-6; AI3-15287; alpha-Pyridinamine; A77989_ALDRICH; .alpha.-Aminopyridine; 1,2-Dihydro-2-iminopyridine; pyridin-2-amine; 2-Pyridinylnitrene; 2-Pyridinamine; AIDS-020430; 45505-67-7; EINECS 207-988-4; AIDS020430; Pyridinamine (9CI); Pyridine, amino-; InChI=1/C5H6N2/c6-5-3-1-2-4-7-5/h1-4H,(H2,6,7; .alpha.-Pyridylamine |
C5H6N2 |
94.11 g/mol |
C1=CC=NC(=C1)N |
|
TCMBANKIN015005 |
Durenol |
51002-84-7; 50356-14-4; CCRIS 5844; Phenol, 2,3,5,6-tetramethyl-; AG-777/36181010; 527-35-5; 2,3,5,6-Tetramethylphenol; EINECS 208-415-0; NSC 65612; Phenol, tetramethyl-; NSC65612; NCIOpen2_000269 |
C10H14O |
150.22 |
CC1=CC(=C(C(=C1C)O)C)C |
|
TCMBANKIN015060 |
Anisketone |
1-(p-Methoxyphenyl)-2-propanone (natural); 64861_FLUKA; NSC 22983; 4-08-00-00460 (Beilstein Handbook Reference); 2-Propanone, 1-(4-methoxyphenyl)-; FEMA No. 2674; 122-84-9; Anisyl methyl ketone; p-Methoxybenzyl methyl ketone; InChI=1/C10H12O2/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H; p-Methoxyphenylacetone; ST5406450; 1-(4-Methoxyphenyl)-2-propanone; 1-(p-Anisyl)-2-propanone; 2-Propanone, 1-(p-methoxyphenyl)-; ghl.PD_Mitscher_leg0.658; (p-Methoxyphenyl)-2-propanone; p-Anisylactone; EINECS 204-578-7; AI3-37913; Anisic ketone; 1-(4-methoxyphenyl)propan-2-one; BRN 2044332; 1-(4-methoxyphenyl)acetone; 4'-Methoxyphenyl-2-propanone; p-Acetonylanisole; W267406_ALDRICH; Anisolacetone; anisketone; 199176_ALDRICH; 4-Methoxyphenylacetone; 2-Propanone, (p-methoxyphenyl)-; 1-(p-Methoxyphenyl)-2-propanone; NSC46101; ZINC01848437; NSC22983; 4-Methoxybenzyl methyl ketone; Anisalacetone |
C10H12O2 |
164.2 |
CC(=O)CC1=CC=C(C=C1)OC |
|
TCMBANKIN015701 |
cyclobutylbenzene |
4392-30-7; Benzene, cyclobutyl-; Cyclobutane, phenyl- |
C10H12 |
132.2 |
C1CC(C1)C2=CC=CC=C2 |
|
TCMBANKIN015766 |
WLN: SH1R |
EINECS 202-862-5; alpha-Toluolthiol; .alpha.-Toluenethiol; 543934_ALDRICH; c0895; HSDB 2105; Thiobenzyl alcohol; 16528-58-8; FEMA No. 2147; Benzenemethanethiol; W214701_ALDRICH; InChI=1/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H; 4-06-00-02632 (Beilstein Handbook Reference); ZINC03873647; 13540_FLUKA; Phenylmethanethiol; NSC 41897; 63767_FLUKA; Benzylthiol; alpha-Tolyl mercaptan; .alpha.-Toluolthiol; 589985_ALDRICH; USAF ex-1509; (Mercaptomethyl)polystyrene; Methanethiol, phenyl-; NSC41897; BRN 0605864; Thiol, polymer-bound; Benzylhydrosulfide; (Mercaptomethyl)benzene; .alpha.-Tolyl mercaptan; NSC229567; 100-53-8; Usaf ek-1509; B25401_ALDRICH; Benzyl hydrosulfide; alpha-Toluenethiol; Phenylmethyl mercaptan; Toluene, alpha-mercapto-; AI3-22955; Mercaptomethyl, polymer-bound; .alpha.-Mercaptotoluene; BENZYL MERCAPTAN; alpha-Mercaptotoluene; Toluene-alpha-thiol |
C7H8S |
124.21 g/mol |
C1=CC=C(C=C1)CS |
|
TCMBANKIN015846 |
Sympamin |
(S)-alpha-methylbenzeneethanamine; (+)-alpha-Methylphenylethylamine; (S)-(+)-beta-Phenylisopropylamine; Dexamfetamine (INN); Dextroamphetamine; Benzeneethanamine, alpha-methyl-, (alphaS)-; Phenethylamine, alpha-methyl-, d-; d-1-Phenyl-2-aminopropan [German]; Dexanfetamina [INN-Spanish]; Benzeneethanamine, alpha-methyl-, (S)-; 4-12-00-02587 (Beilstein Handbook Reference); D03740; (S)-alpha-Methylphenethylamine; (2S)-1-phenylpropan-2-amine; D-(+)-Amphetamine; (+)-alpha-Methylphenethylamine; Dextroamphetamine [USAN]; PDSP2_001495; d-alpha-Methylphenethylamine; Phenethylamine, alpha-methyl-, (+)- (8CI); [(1S)-1-methyl-2-phenyl-ethyl]amine; 51-64-9; Dexamfetamine; Dexidrine; (alphaS)-alpha-methylbenzeneethanamine; (+)-Phenaminum; Dexadrine; (+)-(S)-Amphetamine; alpha-Methylphenethylamine, d-form; C07884; Dextroamphetamine (USAN); Desamfetamina [DCIT]; Dexamphetaminum [INN-Latin]; (S)-1-Phenyl-2-aminopropane; Dexamfetamina [INN-Spanish]; (S)-1-Phenyl-2-propanamine; (2S)-(+)-Amphetamine; PDSP1_001511; BRN 2205872; HSDB 3055; NSC 73713; Dexamfetaminum [INN-Latin]; EINECS 200-112-1; CHEBI:4469; DEA No. 1100; (S)-1-Phenyl-2-propylamine; Desamfetamina; Benzeneethanamine, alpha-methyl-, (aS)- (9CI); (S)-alpha-Phenylethylamine; Phenethylamine, alpha-methyl-, (+)- |
C9H13N |
135.21 |
CC(CC1=CC=CC=C1)N |
|
TCMBANKIN016391 |
N-Nitroso-3-pyrroline |
2,5-Dihydro-1-nitroso-1H-pyrrole; BRN 0106739; 1-nitroso-3-pyrroline; 3-PYRROLINE, N-NITROSO-; 3-Pyrroline, 1-nitroso-; Nitroso-3-pyrrolin [German]; 10552-94-0; 1H-Pyrrole, 2,5-dihydro-1-nitroso-; 5-20-04-00277 (Beilstein Handbook Reference); 1-nitroso-2,5-dihydropyrrole |
C4H6N2O |
98.1 |
C1C=CCN1N=O |
|
TCMBANKIN016437 |
1-methyl-1H-indene |
|
C10H10 |
130.19 |
CC1C=CC2=CC=CC=C12 |
|
TCMBANKIN016557 |
lutidine |
alpha,alpha'-Lutidine; AC-907/25014177; AI3-24282; .alpha.,.alpha.'-Dimethylpyridine; 2,6-Dimethypyridine; HSDB 79; 04991_FLUKA; CHEBI:32548; NSC2155; L3900_SIAL; 108-48-5; alpha,alpha'-Dimethylpyridine; .alpha.,.alpha.'-Lutidine; ZINC00967330; 336106_ALDRICH; FEMA No. 3540; W354007_ALDRICH; InChI=1/C7H9N/c1-6-4-3-5-7(2)8-6/h3-5H,1-2H; 2,6-Dimethylpyridine; 2,6-Lutidine; Pyridine, 2,6-dimethyl-; NSC 2155; EINECS 203-587-3 |
C7H9N |
107.15 |
CC1=NC(=CC=C1)C |
|
TCMBANKIN017617 |
PAC |
Kyselina fenyloctova [Czech]; HSDB 5010; NSC 125718; STK297835; CHEBI:30745; AI3-08920; Benzeneacetiic acid; NCI60_000596; 103-82-2; 2-Phenylacetic acid; Acetic acid, phenyl-; Phenylacetic acid (natural); 2-Phenylethanoic acid; InChI=1/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10; BRN 1099647; alpha-Toluic acid; NSC125718; Benzylformic acid; PHENYL-ACETIC ACID; Phenylacetic acid; FEMA No. 2878; P16621_ALDRICH; Phenylethanoic acid; .omega.-Phenylacetic acid; PAA; Benzylcarboxylic acid; .alpha.-Toluic acid; NCI60_002571; P6061_SIGMA; Benzenacetic acid; Phenyllacetic acid; AIDS-017618; Benzeneacetic acid; W287806_ALDRICH; 51146-16-8; 4-09-00-01614 (Beilstein Handbook Reference); C07086; W287814_ALDRICH; alpha-Tolylic acid; AIDS017618; NCGC00159477-02; EINECS 203-148-6; NSC139637 |
C8H8O2 |
136.15 |
C1=CC=C(C=C1)CC(=O)O |
|
TCMBANKIN017626 |
N-Methylvalerolactam |
1-Methyl-2-piperidone; EINECS 213-231-9; 1-Methyl-2-piperidinone; 2-Piperidone, 1-methyl-; NSC67384; AI3-11535; NSC 67384; N-Methyl-.delta.-valerolactam; 1-methylpiperidin-2-one; M73788_ALDRICH; InChI=1/C6H11NO/c1-7-5-3-2-4-6(7)8/h2-5H2,1H; N-Methyl-2-piperidinone; N-Methyl-2-piperidone; 5-21-06-00398 (Beilstein Handbook Reference); 68876_FLUKA; BRN 0001708; 931-20-4; 1-Methylpiperidine-2-one; 2-Piperidinone, 1-methyl- |
C6H11NO |
113.16 |
CN1CCCCC1=O |
|
TCMBANKIN017783 |
Butyrophenone |
InChI=1/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H; W504904_ALDRICH; 1-Phenyl-1-butanone; 1-phenylbutan-1-one; Propyl phenyl ketone; 495-40-9; 1-Butanone, 1-phenyl-; n-Butyrophenone; AI3-02062; 20770_FLUKA; ZINC01586755; NSC 8463; EINECS 207-799-7; 124338_ALDRICH; Phenyl propyl ketone; NSC8463 |
C10H12O |
148.2 |
CCCC(=O)C1=CC=CC=C1 |
|
TCMBANKIN018110 |
Methyl benzyl ether |
NSC 8058; Benzene, (methoxymethyl)-; .alpha.-Methoxytoluene; ST5410734; Ether, benzyl methyl (8CI); AI3-21993; Benzyl methyl ether; InChI=1/C8H10O/c1-9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H; 476730_ALDRICH; (methoxymethyl)benzene; EINECS 208-705-7; NSC8058; FR-1351; ZINC01586379; alpha-Methoxytoluene; Ether, benzyl methyl; 538-86-3; METHOXYMETHYLBENZENE; methyl benzyl ether |
C8H10O |
122.16 |
COCC1=CC=CC=C1 |
|
TCMBANKIN018115 |
(3S)-3-methylcyclohexan-1-one |
ZINC03860607; (3S)-3-methyl-1-cyclohexanone |
C7H12O |
112.17 |
CC1CCCC(=O)C1 |
|
TCMBANKIN018639 |
N-Ethylpyrrole |
Pyrrole, 1-ethyl-; ZINC01866964; 1-Ethylpyrrole; 617-92-5; 1H-Pyrrole, 1-ethyl-; NSC6756; 92933-61-4 |
C6H9N |
95.14 |
CCN1C=CC=C1 |
|
TCMBANKIN018683 |
Dehydromevalonic lactone |
2,3-Anhydromevalonic acid; InChI=1/C6H8O2/c1-5-2-3-8-6(7)4-5/h4H,2-3H2,1H; 2381-87-5; 4-methyl-5,6-dihydro-2H-pyran-2-one; 4-methyl-5,6-dihydropyran-2-one; ghl.PD_Mitscher_leg0.315; 2H-pyran-2-one, 5,6-dihydro-4-methyl- |
C6H8O2 |
112.13 |
CC1=CC(=O)OCC1 |
|
TCMBANKIN018686 |
MBT |
SPBio_001851; SPECTRUM1504225; Ekagom G; Spectrum_001669; 55199-93-4; Mebithizol; Rotax; 1,3-Benzothiazole-2-thiol; Pennac MBT powder; Mercaptobenzothiazole; ST5308219; NCGC00091643-02; Pneumax MBT; Mercaptobenzothiazol; Kaptax; SpecPlus_000728; 119170-41-1; 12640-90-3; Kaptax [Czech]; 112242-83-8; 4464-58-8; KBioSS_002149; 2-Mercaptobenzothiazole (in liquid mixtures); KBio2_002149; KBio1_001768; 149-30-4; KBio2_007285; WLN: T56 BN DSJ CSH; Accelerator M; KBio3_002669; ST023801; C14437; ZINC00100105; Benzothiazole-2-thione; Caswell No. 541; NSC 2041; KBioGR_001216; EINECS 205-736-8; HSDB 4025; Nuodex 84; Rokon; Vulkacit Mercapto; ZINC00074832; Soxinol M; Accel M; Spectrum2_001666; Spectrum3_001665; Royal MBT; KBio2_004717; CCRIS 891; Spectrum5_001400; BSPBio_003449; NCGC00091643-05; Dermacid; Captax; Mercaptobenzthiazole; 2-Merkaptobenzthiazol [Czech]; AG 63; Usaf gy-3; EPA Pesticide Chemical Code 051701; 2-Mercptobenzothiazole; 2-Benzothiazolinethione; 2-MBT; AIDS019694; NCGC00091643-01; AI3-00985; NCI-C56519; 81605-65-4; c1019; DivK1c_006824; 63730_FLUKA; Benzothiazole, mercapto-; M3302_ALDRICH; 76154_FLUKA; Benzothiazole-2-thiol; Mertax; Benzothiazolethiol; 2-Mercaptobenzothiazole; Nuodeb 84; AIDS-019694; 3H-1,3-benzothiazole-2-thione; Vulkacit Mercapto/C; Thiotax; Kaptaks; Usaf xr-29; 2-Benzothiazolethiol; 2-Merkaptobenzotiazol [Polish]; Spectrum4_000628; NSC2041; Sulfadene; Vulkacit M; Mebetizole; 2-Benzothiazolyl mercaptan; 2(3H)-Benzothiazolethione; 2-Mercaptobenzthiazole; 63720_FLUKA; NCGC00091643-04; Mercaptobenzothiazole (VAN) |
C7H5NS2 |
167.25 |
C1=CC=C2C(=C1)NC(=S)S2 |
|
TCMBANKIN018731 |
Cyclobutanol, 1-ethyl- |
84256-19-9; 1-ethyl-1-cyclobutanol; 1-ethylcyclobutan-1-ol |
C6H12O |
100.16 g/mol |
CCC1(CCC1)O |
|
TCMBANKIN018746 |
WLN: QR CG |
m-Chlorophenic acid; ZINC00404329; C14270; HSDB 1413; CHEBI:38855; InChI=1/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8; CCRIS 641; 3CH; 108-43-0; NSC59700; 25840_FLUKA; 36747_RIEDEL; m-Chlorophenol, liquid [UN2021] [Keep away from food]; Phenol, m-chloro-; EINECS 203-582-6; 3-Chlorophenol; 3-Hydroxychlorobenzene; NSC 59700; C62808_ALDRICH; AI3-23961; m-Chlorophenol; NCGC00091698-01; 3-Chloro-1-hydroxybenzene; m-Chlorophenol, solid [UN2020] [Keep away from food]; Phenol, 3-chloro- |
C6H5ClO |
128.56 |
C1=CC(=CC(=C1)Cl)O |
|
TCMBANKIN019480 |
[(1R)-1-methoxyethyl]benzene |
|
|
136.21 |
|
|
TCMBANKIN019591 |
WLN: T5NJ A1 BVH |
EINECS 214-755-0; 1-Methyl-1H-pyrrole-2-carboxaldehyde; N-METHYL-2-FORMYLPYRROLE; 1H-Pyrrole-2-carboxaldehyde, 1-methyl-; 2-Formyl-1-methylpyrrole; 130052_ALDRICH; 1-methyl-2-pyrrolecarboxaldehyde; InChI=1/C6H7NO/c1-7-4-2-3-6(7)5-8/h2-5H,1H; ST5213397; 5-21-07-00177 (Beilstein Handbook Reference); ZINC00130187; 1-Methylpyrrole-2-carbaldehyde; 1192-58-1; N-Methyl-2-pyrrolecarboxaldehyde; NSC 72386; NSC72386; BRN 0107811 |
C6H7NO |
109.13 |
CN1C=CC=C1C=O |
|
TCMBANKIN019599 |
(2S,4S)-2,4-dimethyl-1,3-dioxane |
|
C6H12O2 |
116.16 |
|
|
TCMBANKIN019652 |
D-Phenylalanine |
EINECS 211-603-5; Spectrum4_000865; Spectrum5_001137; (2R)-2-amino-3-phenyl-propionic acid; 673-06-3; CHEBI:16998; (2R)-2-amino-3-phenylpropanoic acid; SPECTRUM1503391; KBio1_000453; C02265; KBio2_002205; 78030_FLUKA; KBio2_007341; (2R)-2-amino-3-phenyl-propanoic acid; NINDS_000453; Phenylalanine D-form; NCGC00163338-01; InChI=1/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12; D-alpha-Amino-beta-phenylpropionic acid; SPBio_001436; CCRIS 6267; KBioSS_002205; IDI1_000453; Spectrum2_001558; NCI-C60195; NSC 25005; DivK1c_000453; (R)-2-Amino-3-phenylpropionic acid; P1751_SIGMA; Spectrum_001725; 10549-11-8; KBio2_004773; KBioGR_001529 |
C9H11NO2 |
165.19 |
C1=CC=C(C=C1)CC(C(=O)O)N |
|
TCMBANKIN019771 |
Ethyl p-toluate |
p-Toluic acid, ethyl ester; 4-methylbenzoic acid ethyl ester; InChI=1/C10H12O2/c1-3-12-10(11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H; 94-08-6; EINECS 202-301-4; NSC24767; ZINC00164611; 172693_ALDRICH; Benzoic acid, 4-methyl-, ethyl ester; Ethyl 4-methylbenzoate; AI3-31106; ST5406825; Ethyl p-methylbenzoate; p-Toluic acid ethyl ester |
C10H12O2 |
164.2 g/mol |
CCOC(=O)C1=CC=C(C=C1)C |
|
TCMBANKIN019832 |
Cysteine |
|
C3H7NO2S |
121.16 g/mol |
C(C(C(=O)[O-])[NH3+])S |
|
TCMBANKIN020012 |
m-Anisidine |
CCRIS 5886; m-Methoxyaniline; 536-90-3; 4-13-00-00953 (Beilstein Handbook Reference); m-Aminoanisole; 3-Anisidine; AI3-52519; NSC7631; EINECS 208-651-4; InChI=1/C7H9NO/c1-9-7-4-2-3-6(8)5-7/h2-5H,8H2,1H; Benzenamine, 3-methoxy-; ST5213832; NCGC00091221-01; A88204_ALDRICH; 3-Methoxybenzenamine; BRN 0386119; NSC 7631; 3-Aminoanisole; m-Anisylamine; ZINC00157531; 1-Amino-3-methoxybenzene; 3-Methoxyaniline; (3-methoxyphenyl)amine; 10480_FLUKA |
C7H9NO |
123.15 |
COC1=CC=CC(=C1)N |
|
TCMBANKIN020210 |
Odhpca |
4-keto-1H-pyridine-3-carboxylic acid; 3-Pyridinecarboxylic acid, 4-hydroxy-; EINECS 210-197-7; 4-oxo-1H-pyridine-3-carboxylic acid; IDI1_010722; MLS000085094; 4-Hydroxy-3-pyridinecarboxylic acid; 72676-96-1; 4-Oxo-1,4-dihydro-3-pyridinecarboxylic acid; Oprea1_654715; 609-70-1; EC-000.1401; IFLab1_005319; 4-Hydroxynicotinic acid; SMR000019640 |
C6H5NO3 |
139.11 |
C1=CNC=C(C1=O)C(=O)O |
|
TCMBANKIN020336 |
[(2R)-pentan-2-yl]benzene |
[(1R)-1-methylbutyl]benzene |
C11H16 |
148.24 |
|
|
TCMBANKIN020770 |
Sym-m-xylenol |
3,5-Dimethyl phenol; NSC 9268; InChI=1/C8H10O/c1-6-3-7(2)5-8(9)4-6/h3-5,9H,1-2H; 3,5-Dimethylphenol solution; 3,5-Dimethylphenol; 3,5-Xylenol; EINECS 203-606-5; sym.-m-Xylenol; 442379_SUPELCO; NCGC00091574-01; 50356-23-5; 3,5-Dmp; AI3-01553; 5-Hydroxy-m-xylene; 108-68-9; ST5409867; HSDB 5385; NSC9268; WLN: QR C1 E1; 1,5-Dimethyl-3-hyperoxybenzene; Xylenol 200; 36717_RIEDEL; CHEBI:38572; Phenol, 3,5-dimethyl-; Benzene, 1,3-dimethyl-5-hydroxy-; ZINC01699887; 1,3,5-Xylenol; 1-Hydroxy-3,5-dimethylbenzene; CCRIS 724; 144134_ALDRICH |
C8H10O |
122.16 |
CC1=CC(=CC(=C1)O)C |
|
TCMBANKIN020794 |
m-Picoline |
3-Picoline; m-Methylpyridine; NCGC00091447-01; .beta.-Picoline; beta-Picoline; 80230_FLUKA; 3-Mepy; HSDB 4254; NSC 18251; 3-Methyl pyridine; 236276_ALDRICH; Pyridine, 3-methyl-; NSC18251; CCRIS 1722; 82005-08-1; 3-Methylpyridine; AI3-24110; .beta.-Methylpyridine; InChI=1/C6H7N/c1-6-3-2-4-7-5-6/h2-5H,1H; EINECS 203-636-9; 108-99-6; 61204-14-6; m-Picoline [UN2313] [Flammable liquid]; CHEBI:39922; NCIOpen2_004641; beta-Methylpyridine; P42053_ALDRICH; 3-Pyridylmethyl radical |
C6H7N |
93.13 |
CC1=CN=CC=C1 |
|
TCMBANKIN020906 |
p-Ethylphenetole |
Benzene, 1-ethoxy-4-ethyl-; 1-Ethoxy-4-ethylbenzene; 1-ethoxy-4-ethyl-benzene; EINECS 216-438-2; 1585-06-4 |
C10H14O |
150.22 |
CCC1=CC=C(C=C1)OCC |
|
TCMBANKIN021220 |
4-amino-5-ethoxyimidazole |
|
|
127.17 |
|
|
TCMBANKIN021718 |
cabraleadiol |
|
C30H52O3 |
460.73 |
CC1(C2CCC3(C(C2(CCC1O)C)CCC4C3(CCC4C5(CCC(O5)C(C)(C)O)C)C)C)C |
|
TCMBANKIN022181 |
(2R)-3-methylbutan-2-ol |
ZINC01696686; InChI=1/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H |
C5H12O |
88.15 |
CC(C)C(C)O |
|
TCMBANKIN022392 |
(1S)-1-phenylethanamine |
(S)-alpha-Methylbenzenemethanamine; [(1S)-1-phenylethyl]amine; EINECS 220-098-0; 115568_ALDRICH; 77869_FLUKA; Benzenemethanamine, alpha-methyl-, (alphaS)-; L(-)-alpha-methylbenzylamine; 77870_FLUKA; (-)-alpha-phenethylamine; (alphaS)-alpha-methylbenzenemethanamine; CHEBI:35321; 137577-63-0; 2627-86-3; L-(-)-alpha-phenylethylamine; (S)-(−)-alpha-Methylbenzylamine; L-alpha-Methylbenzylamine; (S)-(-)-alpha-methylbenzylamine; L-(-)-1-phenylethylamine; (S)-(−)-1-Phenylethylamine |
C8H11N |
121.18 |
CC(C1=CC=CC=C1)N |
|
TCMBANKIN022528 |
2-methyl-5-(1-methylene)-1,3-cyclohexadiene |
|
|
106.18 |
|
|
TCMBANKIN023552 |
Durol |
p-Xylene, 2,5-dimethyl- (7CI); C14534; 95-93-2; Benzene, 1,2,4,5-tetramethyl-; NCIMech_000514; 44624_FLUKA; ST5188811; AI3-25182; 2,5-dimethyl-p-xylene; WLN: 1R B1 D1 E1; InChI=1/C10H14/c1-7-5-9(3)10(4)6-8(7)2/h5-6H,1-4H; Durene; CHEBI:38978; 1,2,4,5-Tetramethylbenzene; NSC 6770; NSC6770; EINECS 202-465-7; T19607_ALDRICH |
C10H14 |
134.22 |
CC1=CC(=C(C=C1C)C)C |
|
TCMBANKIN023616 |
Purine |
purine; PURINE-RING; CHEBI:17258; 6H-Imidazo(4,5-d)pyrimidine; 9H-Purine; 3,5,7-TRIAZAINDOLE; AC-907/25014050; X 128; AIDS023033; 120-73-0; EINECS 204-421-2; C00465; P55805_ALDRICH; C15587; 6H-Imidazo[4,5-d]pyrimidine; 82580_FLUKA; SBB004288; InChI=1/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9; ZINC00152268; 7H-Imidazo[4,5-d]pyrimidine; CHEBI:35589; .beta.-Purine; AI3-50208; 3H-purine; AIDS-023033; NSC 753; 1H-Purine; P1655_SIGMA; Imidazo[4,5-d]pyrimidine; 7H-Purine; NSC753; CHEBI:35586; 1H-Purine (9CI); 9H-Purine (VAN); Imidazo(4,5-d)pyrimidine; CHEBI:35588; Isopurine; beta-Purine; 7H-Imidazo(4,5-d)pyrimidine; WLN: T56 BM DN FN HNJ |
C5H4N4 |
120.11 |
C1=C2C(=NC=N1)N=CN2 |
|
TCMBANKIN024503 |
1-isochromanone |
isochroman-1-one; 4702-34-5; 3,4-Dihydro-1H-2-benzopyran-1-one; EINECS 225-179-4; Dihydroisocoumarin; 3,4-Dihydro-1H-isochromen-1-one; 1H-2-Benzopyran-1-one, 3,4-dihydro- |
C9H8O2 |
148.16 |
C1COC(=O)C2=CC=CC=C21 |
|
TCMBANKIN024513 |
o-Methylanisole |
Anisole, o-methyl-; Benzene, 1-methoxy-2-methyl-; 578-58-5; 2-Methoxytoluene; EINECS 209-426-3; W268003_ALDRICH; ZINC01693358; o-Cresyl methyl ether; AI3-23983; 2-Methylmethoxybenzene; o-Methoxytoluene; 2-Methylanisole; o-Cresol methyl ether; FEMA No. 2680; Anisole, o-methyl- (8CI); 1-Methoxy-2-methylbenzene; 1-methoxy-2-methyl-benzene; InChI=1/C8H10O/c1-7-5-3-4-6-8(7)9-2/h3-6H,1-2H; Methyl o-tolyl ether; NSC6253; Methoxytoluene, o-; NSC 6253; M29355_ALDRICH; Methyl o-cresyl ether |
C8H10O |
122.16 |
CC1=CC=CC=C1OC |
|
TCMBANKIN024553 |
(2R)-butan-2-amine |
(R)-(−)-sec-Butylamine; 296643_ALDRICH; (R)-(−)-2-Aminobutane |
C4H11N |
73.14 |
CCC(C)N |
|
TCMBANKIN025246 |
Cyclooctene |
cis-Cyclooctene; 21395-82-4; NCIOpen2_000391; cyclooctene, (1E)-; 931-87-3; AI3-26693; (1E)-cyclooctene; NSC 72425; (7Z)-cyclooctene; 931-88-4; 29648_FLUKA; NSC72425; 125482_ALDRICH; Cyclooctene, (Z)-; (1Z)-cyclooctene; InChI=1/C8H14/c1-2-4-6-8-7-5-3-1/h1-2H,3-8H2/b2-1; cyclooctene, (1Z)-; 931-89-5; EINECS 213-243-4; (Z)-Cyclooctene; trans-Cyclooctene; EINECS 213-245-5; (7E)-cyclooctene; Cyclooctene, (E)- |
C8H14 |
110.2 |
C1CCCC=CCC1 |
|
TCMBANKIN025660 |
Vinylxylene |
Benzene, ethenyl-, dimethyl deriv.; Benzene, 1-ethenyl-2,3-dimethyl-; DIMETHYLSTYRENE; 1,2-Dimethyl-3-Vinylbenzene; 1-ethenyl-2,3-dimethyl-benzene; 27576-03-0; 27496-76-0; EINECS 248-495-4; 1-ethenyl-2,3-dimethylbenzene; 1,2-dimethyl-3-vinyl-benzene; 40243-75-2; 2,3-Dimethylstyrene; Methyl 2,3-di-O-benzyl-4,6-di-S-benzyl-4,6-dithiohexopyranoside |
C10H12 |
132.2 g/mol |
CC1=C(C(=CC=C1)C=C)C |
|
TCMBANKIN026559 |
benzenemethanol |
Aromatic primary alcohol; 3983-EP2298734A2; D05OIS; Benzyl alcohol, polymer-bound, 70-90 mesh, extent of labeling: 2.0-3.0 mmol loading, 1 % cross-linked; Benzyl alcohol, USP, 98.0-100.5%; NSC 406252-d5; Benzyl alcohol, Vetec(TM) reagent grade, 98%; 3983-EP2308873A1; Alcool benzilico [DCIT]; 3983-EP2311842A2; 3983-EP2292612A2; Benzyl alcohol [USAN:INN:JAN]; 3983-EP2305696A2; 3983-EP2275401A1; J-000153; WVDDGKGOMKODPV-UHFFFAOYSA-N; 3983-EP2277568A2; 3983-EP2308854A1; benzylic alcohol; TR-033774; EINECS 202-859-9; 3983-EP2272841A1; PhCH2OH; Jsp000133; Benzyl alcohol, SAJ first grade, >=98.5%; 3983-EP2298744A2; Benzyl alcohol, polymer-bound, 100-200 mesh, extent of labeling: 1.0-2.0 mmol/g loading, 1 % cross-linked with divinylbenzene; Benzyl alcohol, polymer-bound, 70-90 mesh, extent of labeling: 0.5-1.0 mmol/g loading, 1 % cross-linked with divinylbenzene; Benzoyl alcohol; CTK0H6356; 3983-EP2280010A2; 3983-EP2270011A1; Benzyl alcohol, Pharmaceutical Secondary Standard; Certified Reference Material; Benzyl alcohol, polymer-bound; NSC8044; PENTADEOTEROBENZYL ALCOHOL; Benzylalkohol; 3983-EP2292614A1; Tox21_111172; 3983-EP2308858A1; benzylalcohol; STL163453; Benzyl alcohol, puriss. p.a., ACS reagent, >=99.0% (GC); Pharmakon1600-01502555; Polystyrene cross-linked with divinylbenzene, hydroxymethylated; I01-4406; Benzyl alcohol, analytical standard; DTXSID5020152; AS04466; ZB015017; (Hydroxymethyl)benzene; Benzyl alcohol, anhydrous, 99.8%; 3983-EP2270004A1; 3983-EP2287155A1; Caswell No. 081F; 3983-EP2305808A1; Sunmorl BK 20; EC 202-859-9; Benzal alcohol; 3983-EP2275411A2; RTR-033774; benzene-methanol; 3983-EP2275102A1; 3983-EP2301931A1; 2-PHENYL-D5-ETHANOL; 3983-EP2277569A2; 3983-EP2277570A2; KB-200532; 3983-EP2308846A2; 3983-EP2316831A1; Alcool benzilico; 3983-EP2295406A1; (Hydroxymethyl)polystyrene, 200-500 mesh, extent of labeling: ~1.1 mmol/g loading; 3983-EP2305640A2; CHEMBL720; 3983-EP2308845A2; 3983-EP2280008A2; Benzyl alcohol, United States Pharmacopeia (USP) Reference Standard; TOLUENE,ALPHA-HYDROXY; 3983-EP2295411A1; 3983-EP2292615A1; alcoholum benzylicum; BC222892; phenylmethanol; C6H5CH2OH; Phenyl-Methanol; MFCD00004599; (Hydroxymethyl)polystyrene, 200-400 mesh, extent of labeling: ~1.7 mmol/g loading; A800221; DTXSID40470349; NCGC00091865-01; InChI=1/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H; KSC176G5N; 3983-EP2280001A1; 3983-EP2287160A1; 3983-EP2289888A2; Itch-X; 3983-EP2311817A1; BENZYL ALCOHOL, U.S.P./N.F.; D00077; Benzyl alcohol, puriss., meets analytical specification of Ph.??Eur., BP, NF, 99-100.5% (GC); enzylalcohol; AKOS000119907; 2-(2,3,4,5,6-pentadeuteriophenyl)ethanol; 3983-EP2277867A2; Benzyl alcohol, >=99%, FCC, FG; Bentanol; NSC 8044; 3983-EP2380568A1; BENZYL ALCOHOL, ACS; 3983-EP2295426A1; 3983-EP2316836A1; Benzencarbinol; Phenylcarbinolum; hydroxy(phenyl)methyl; Methanol, phenyl-; Benzyl Alcohole; 3983-EP2311823A1; Benzyl alcohol (natural); Bn-OH; Benzalalcohol; Phenyl Methanol; 3983-EP2275414A1; SBB058558; 3983-EP2270505A1; C03485; 2-Phenyl-d5-ethanol, 98 atom % D, 98% (CP); a-Hydroxytoluene; 3983-EP2372017A1; EPA Pesticide Chemical Code 009502; 3983-EP2311829A1; Alcool benzylique; Benzyl alcohol, ACS reagent, >=99.0%; Alcoolbenzylique; 3983-EP2298783A1; 3983-EP2308875A1; 3983-EP2298768A1; Tox21_300044; 3983-EP2289887A2; 3983-EP2287166A2; 3983-EP2280003A2; 3983-EP2311831A1; Benzyl alcohol, LR, >=99%; 3983-EP2311806A2; I765; DSSTox_RID_75404; Benzenecarbinol; DSSTox_GSID_20152; LS41488; 3983-EP2272813A2; NCGC00254154-01; 2-[(2,3,4,5,6-(2)H?)PHENYL]ETHANOL; 3983-EP2295413A1; 3983-EP2308857A1; Phenylethyl Alcohol-d5; 3983-EP2277879A1; 3983-EP2311837A1; 3983-EP2314585A1; TB 13G; OBZ; 3983-EP2374454A1; BB_SC-7027; FT-0622812; C00556; Ulesfia; 3983-EP2305636A1; 3983-EP2305695A2; 3983-EP2277876A1; AK146334; BDBM16418; 3983-EP2314584A1; FT-0673679; CHEBI:17987; MFCD03792087; ACM35845637; Benzyl alcohol Natural; 3983-EP2305698A2; Benzyl alcohol, p.a., ACS reagent, 99.0%; Phenethyl Alcohol-d5; 3983-EP2295437A1; 3983-EP2298750A1; 4-06-00-02222 (Beilstein Handbook Reference); BIDD:ER0248; (Hydroxymethyl)polystyrene; SCHEMBL147; HMS3264B16; 3983-EP2308870A2; Polystyrene crosslinked with divinylbenzene, hydroxymethylated; AJ-24171; 3983-EP2305697A2; Nat. Benzyl Alcohol; CAS-100-51-6; 3983-EP2298755A1; 2-Phenethanol-d5; 3983-EP2270005A1; 3983-EP2374790A1; Benzyl alcohol, ReagentPlus(R), >=99%; 3983-EP2316834A1; 3983-EP2314575A1; 3983-EP2308833A2; 3983-EP2308812A2; Aromatic alcohol; 3983-EP2298743A1; 3983-EP2305651A1; Phenylmethyl alcohol; UNII-LKG8494WBH; alpha-hydroxytoluene; NCGC00259996-01; 3983-EP2295427A1; FEMA No. 2137; Benzeneethanol-d5; 3983-EP2316829A1; 3983-EP2316470A2; 3983-EP2292227A2; 100-51-6; 1336-27-2; StratoSpheres™ PL-HMS (Hydroxymethylstyrene) resin; MolPort-001-783-216; hydroxymethylbenzene; Benzylicum; 3983-EP2277565A2; NCGC00091865-02; Hydroxytoluene; a-Toluenol; 3983-EP2298775A1; Benzalcohol; Euxyl K 100; BnOH; BRN 0878307; 3983-EP2292596A2; Hydroxymethyl polystyrene; HY-B0892; Benzyl alcohol, polymer-bound, 100-200 mesh, extent of labeling: 0.5-1.0 mmol/g loading, 1 % cross-linked; CCG-213843; 3983-EP2289892A1; 3983-EP2274983A1; DSSTox_CID_152; Benzyl alcohol, natural, >=98%, FG; B2378; PINAPUR™ 9 BA-R; Benzyl alcohol, tested according to Ph.Eur.; 3983-EP2280005A1; SC-47293; 3983-EP2298731A1; benzyl alcohol; 3983-EP2272825A2; Benzyl alcohol (JP15/NF); .alpha.-Toluenol; s4600; 3983-EP2272822A1; 3983-EP2277566A2; 3983-EP2281823A2; Benzyl alcohol, PharmaGrade, USP/NF, Ph Eur, Manufactured under appropriate GMP controls for pharma or biopharmaceutical production.; aplha-Hydroxytoluene; 3983-EP2279750A1; F0001-0019; 3983-EP2284160A1; Benzyl alkohol; NCGC00091865-03; Bentalol; 3983-EP2308867A2; 3983-EP2308861A1; benzenmethanol; 3983-EP2295550A2; Benzyl alcohol, AR, >=99.5%; 3983-EP2295412A1; BBL011938; HSDB 46; 3983-EP2275425A1; 3983-EP2308872A1; Alcool benzylique [INN-French]; 3983-EP2374783A1; CCRIS 2081; AI3-01680; Phenolcarbinol; 3983-EP2289884A1; Benzyl alcohol, SAJ special grade, >=99.0%; LKG8494WBH; 3983-EP2295402A2; ZINC895302; 3983-EP2298772A1; LS-307; Benzyl alcohol (JP17/NF/INN); DB06770; 3983-EP2374792A1; Benzyl alcohol, polymer-bound, 70-90 mesh, extent of labeling: 1.0-1.5 mmol/g loading, 1 % cross-linked; 3983-EP2272516A2; Alcoholum benzylicum [INN-Latin]; phenylcarbinol; 3983-EP2308844A2; phenylmethan-1-ol; 3983-EP2277848A1; Methanol benzene; 3983-EP2308877A1; Benzyl alcohol, certified reference material, TraceCERT(R); 3983-EP2289894A2; (2-Hydroxyethyl)benzene-d5; 2-Phenyl-1-ethanol-d5; SR-01000872610; Benzyl alcohol, 99% 250g; 2-Phenylethanol-d5; AC1L18SY; Benzene Carbinol; 3983-EP2287165A2; StratoSpheres(TM) PL-HMS (Hydroxymethylstyrene) resin, 50-100 mesh, extent of labeling: 2.0 mmol loading, 1 % cross-linked; 66072-40-0; 3983-EP2301936A1; Alcohol bencilico; 3983-EP2311834A1; 3983-EP2284149A1; Benzyl alcohol polymer-bound; MCULE-6011707909; NCI-C06111; Benzyl alcohol on polystyrene, 3.5 mmol/g; 35845-63-7; alpha-Toluenol; RP18893; 3983-EP2311815A1; NSC-760098; 3983-EP2292280A1; ST24048908; Alcohol bencilico [INN-Spanish]; ACMC-1BQPG; 3983-EP2301918A1; 3983-EP2311824A1; 3983-EP2269992A1; 3983-EP2277567A1; BENZYL-ALCOHOL; 3983-EP2316835A1; 3983-EP2272817A1; 3983-EP2292611A1; Benzyl alcohol, European Pharmacopoeia (EP) Reference Standard; 3762963D-6C2A-4BFF-AD94-3180E51BCA68; ST51028320; 3983-EP2305673A1; NSC-8044; 3983-EP2292620A2; Ulesfia (TN); AC1Q7C20; NSC760098; Benzyl Alcohol Reagent ACS Grade; bmse000407; 3983-EP2308839A1; E1519; SR-01000872610-3; Benzyl alcohol [INN:JAN:NF]; NCGC00091865-04; AB01563201_01; 3983-EP2280012A2; Z955123784; 3983-EP2308828A2; 185532-71-2; .alpha.-Hydroxytoluene; WLN: Q1R; 3983-EP2305676A1; 3983-EP2311816A1; 3983-EP2305243A1; 3983-EP2298735A1; Tox21_202447 |
C7H8O |
108.14 |
CO.C1=CC=CC=C1 |
|
TCMBANKIN026762 |
WLN: G1R |
TOLUENE,ALPHA-CHLORO; Benzene, chloromethyl-; Chloromethylbenzene; InChI=1/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H; Benzyl chloride, unstabilized [UN1738] [Poison, Corrosive]; Tolyl chloride; Toluene, alpha-chloro-; 185558_ALDRICH; 100-44-7; Merrifield resin; Chlorure de benzyle [French]; UN1738; CCRIS 79; ST5214092; 63862_FLUKA; .omega.-Chlorotoluene; 27987-13-9; (Chloromethyl)polystyrene; .alpha.-Chlorotoluene; NSC 8043; alpha-Chlortoluol [German]; Benzyl chloride; Benzylchlorid [German]; Toluene, .alpha.-chloro-; Benzylchloride; RCRA waste no. P028; NSC8043; NCI-C06360; nchembio814-comp11; BRN 0471308; CHLOROTOLUENE; Benzyl chloride [UN1738] [Poison]; Chlorophenylmethane; Benzile(cloruro di); HSDB 368; alpha-Chlorotoluene; 4-05-00-00809 (Beilstein Handbook Reference); Benzylchlorid; Chlorure de benzyle; 63875_FLUKA; Oxsol 10; 25168-05-2; Benzyle (chlorure de) [French]; Toluene, ar-chloro-; AI3-15518; .alpha.-Chlortoluol; Benzile (cloruro di) [Italian]; RCRA waste number P028; EINECS 246-698-2; 63861_FLUKA; 63864_FLUKA; (Chloromethyl)benzene; 643661_ALDRICH; Benzyle(chlorure de); 63868_FLUKA; NCGC00090818-01; EINECS 202-853-6; Chloromethyl on Rasta Resin; Benzene, (chloromethyl)- |
C7H7Cl |
126.58 g/mol |
C1=CC=C(C=C1)CCl |
|
TCMBANKIN026848 |
Ethylcyclohexane |
QSPL 100; LMFA11000659; TRA0083601; ETHYLCYCLOHEXANE; UNII-567IJI1215; ethyl-cyclohexane; NSC-8880; DSSTox_CID_30334; ST51047216; DSSTox_GSID_51779; AKOS015906531; Cyclohexane, ethyl-; AK114241; CJ-26661; SBB061162; Jsp003393; InChI=1/C8H16/c1-2-8-6-4-3-5-7-8/h8H,2-7H2,1H; NSC 8880; NCGC00357050-01; RL02152; J-010406; WLN: L6TJ A2; NCGC00166032-01; AJ-28747; 567IJI1215; EINECS 216-835-0; Ethylcyclohexane, >=99%; AI3-15348; CAS-1678-91-7; TR-007279; IIEWJVIFRVWJOD-UHFFFAOYSA-N; KB-51542; MFCD00001523; NSC8880; I14-21466; MCULE-9302115958; I14-6754; 8567AA; 1678-91-7; AN-49676; E19154_ALDRICH; Tox21_303745; FCH1116711; ST24030704; ethylcyclohexane; AC1L2616; RTR-007279; cyclohexylethane; A810916; Ethyl cyclohexane; ACMC-1C1QU; LS-56823; J-521341; ZINC1648302; FT-0626176; E0073; CHEMBL1882821; TRA0085673; DTXSID1051779; MolPort-003-933-653 |
C8H16 |
112.21 |
CCC1CCCCC1 |
|
TCMBANKIN026864 |
(1R,4S)-bicyclo[2.2.1]hept-2-ene |
InChI=1/C7H10/c1-2-7-4-3-6(1)5-7/h1-2,6-7H,3-5H |
C7H10 |
94.15 |
C1CC2CC1C=C2 |
|
TCMBANKIN026940 |
o-Cresol, 6-ethyl- |
ZINC02571305; 1687-64-5; 2-ethyl-6-methyl-phenol; Phenol, 2-ethyl-6-methyl-; ST5408891; 2-Ethyl-6-methylphenol |
C9H12O |
136.19 |
CCC1=CC=CC(=C1O)C |
|
TCMBANKIN026954 |
propyl cyclopentane |
Propylcyclopentane; 82180_FLUKA; ST5411564; WLN: L5TJ A3; Cyclopentane, propyl-; n-Propylcyclopentane; BRN 1900338; NSC 73947; EINECS 218-042-5; 4-05-00-00125 (Beilstein Handbook Reference); NSC73947; 1-Cyclopentylpropane; InChI=1/C8H16/c1-2-5-8-6-3-4-7-8/h8H,2-7H2,1H; 2040-96-2 |
C8H16 |
112.21 |
CCCC1CCCC1 |
|
TCMBANKIN027175 |
2-Phenylpropene |
2-phenyl-2-propene; WLN: 1YR & U1; NCGC00090741-01; alpha-Methylstyrene; .alpha.-Metil-stirolo; 81523_FLUKA; .alpha.-Methylstyreen; 81517_FLUKA; Isopropenil-benzolo [Italian]; .beta.-Phenylpropylene; C14395; Isopropenyl-benzol [German]; UN2303; Styrene, .alpha.-methyl-; 42612-14-6; (1-Methylethenyl)benzene; InChI=1/C9H10/c1-8(2)9-6-4-3-5-7-9/h3-7H,1H2,2H; NSC 9400; 1-Methyl-1-phenylethylene; NSC9400; alpha-Metil-stirolo [Italian]; alpha-Methylstyrene monomer; Benzene, (1-methylethenyl)-; beta-Phenylpropylene; 1-Methyl-1-phenylethene; .alpha.-Methylstyrol; EINECS 202-705-0; 81520_FLUKA; prop-1-en-2-ylbenzene; AI3-18133; Ortho Brush Killer A; alpha-Methylstyreen [Dutch]; 25014-31-7; 2-Phenylpropylene; 69170_FLUKA; Isopropenyl-benzeen [Dutch]; Isopropenylbenzene; 81516_FLUKA; HSDB 196; ghl.PD_Mitscher_leg0.286; 81524_FLUKA; alpha-Methyl-styrol [German]; LS-2049; .alpha.-Methylstyrene; .beta.-Phenylpropene; 1-Phenyl-1-methylethylene; Styrene, alpha-methyl-; Isopropenil-benzolo; Isopropenyl-benzeen; 1-Propene, 2-phenyl-; 81519_FLUKA; Isopropenyl-benzol; ALPHA-METHYL STYRENE; 81522_FLUKA; 81513_FLUKA; as-Methylphenylethylene; Poly(alpha-methylstyrene); 81514_FLUKA; 81518_FLUKA; .alpha.-Methyl-styrol; Isopropenylbenzene [UN2303] [Flammable liquid]; 98-83-9; alpha-Methylstyrol; beta-Phenylpropene; 69168_FLUKA; Benzene, (1-methylethenyl)-, homopolymer; 2-Phenyl-1-propene; 1-Methylethylenebenzene; CCRIS 6067; M80903_ALDRICH; 1-MethylethenylBenzine |
C9H10 |
118.18 |
CC(=C)C1=CC=CC=C1 |
|
TCMBANKIN027351 |
2,3-DIMETHYLPYRAZINE |
Pyrazine, 2,3-dimethyl-; 2,3-dimethylpyrazine; FEMA No. 3271; 5910-89-4; 2, 3-dimethyl pyrazine; CCRIS 2928; W327107_ALDRICH; EINECS 227-630-0; 199400_ALDRICH; 2,3-Dimethyl-1,4-diazine; ZINC00003183; 2,3-Dimethylpyrazine (natural); InChI=1/C6H8N2/c1-5-6(2)8-4-3-7-5/h3-4H,1-2H |
C6H8N2 |
108.14 |
CC1=NC=CN=C1C |
|
TCMBANKIN027403 |
1-[(2S)-oxolan-2-yl]ethanone |
1-[(2S)-tetrahydrofuran-2-yl]ethanone; 1-[(2S)-2-tetrahydrofuranyl]ethanone |
C6H10O2 |
114.14 |
CC(=O)C1CCCO1 |
|
TCMBANKIN027454 |
trans-1,2-Cyclopentanediol |
()-trans-1,2-Cyclopentanediol; 459259_ALDRICH; 29722_FLUKA; 1,2-Cyclopentanediol, trans-; 361445_ALDRICH; 29725_FLUKA; NSC15389; 5057-99-8; (1R,2R)-cyclopentane-1,2-diol; (1R,2R)-trans-1,2-Cyclopentanediol |
C5H10O2 |
102.13 |
C1CC(C(C1)O)O |
|
TCMBANKIN027535 |
2-Nitrobenzoic acid |
|
C7H5NO4 |
167.12 |
C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-] |
|
TCMBANKIN027718 |
MHP |
m-hydroxyphenylpropionate; 3-HYDROXYPHENYL-PROPIONATE; 4-10-00-00630 (Beilstein Handbook Reference); AI3-32395; Dihydro-3-coumaric acid; NSC 33135; Benzenepropanoic acid, 3-hydroxy- (9CI); Hydrocinnamic acid, m-hydroxy-; .beta.-(3-Hydroxyphenyl)propionic acid; m-hydroxyphenylpropionic acid; 3-(3-hydroxyphenyl)propionic acid; 3-(3-hydroxyphenyl)propanoic acid; 3HPP; NSC 39468; Benzenepropanoic acid, 3-hydroxy-; BRN 1947445; NSC33135; .beta.-(m-Hydroxyphenyl)propionic acid; beta-(3-Hydroxyphenyl)propionic acid; 3-Hydroxybenzenepropanoic acid; C11457; 3-(3-hydroxyphenyl)propionate; 3-(3-Hydroxy-phenyl)-propanoic acid; NSC39468; beta-(m-Hydroxyphenyl)propionic acid; 621-54-5; CHEBI:1427; 3-(m-Hydroxyphenyl)propionic acid; EINECS 210-692-8; ST5407837; InChI=1/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12; 3-Hydroxyphenylpropanoate; 3-Hydroxyphenylpropionic acid |
C9H10O3 |
166.17 |
C1=CC(=CC(=C1)O)CCC(=O)O |
|
TCMBANKIN028077 |
HAI |
BRN 0471175; c0690; Cyclohexanamine; C00571; C104655_ALDRICH; InChI=1/C6H13N/c7-6-4-2-1-3-5-6/h6H,1-5,7H; 1-AMINO-CYCLOHEXANE; Aniline, hexahydro-; LS-473; ST5213819; 4-12-00-00008 (Beilstein Handbook Reference); Hexahydroaniline; AI3-15323; AIDS-008396; AIDS008396; 1-Cyclohexylamine; Aminocyclohexane; NCI60_004907; Benzenamine, hexahydro-; 1-Aminocyclohexane; 240648_ALDRICH; Cyclohexylamine [UN2357] [Corrosive]; HSDB 918; Aminohexahydrobenzene; Hexahydrobenzenamine; Cyclohexylamine; CHEBI:15773; CCRIS 3645; 143247-75-0; Cyclohexyl amine; UN2357; 108-91-8; 157973-60-9; EINECS 203-629-0 |
C6H13N |
99.17 |
C1CCC(CC1)N |
|
TCMBANKIN028235 |
Methylenecyclopentane |
methylidenecyclopentane; EINECS 216-203-4; methylene cyclopentane; Methylene cyclopentane; 1528-30-9; InChI=1/C6H10/c1-6-4-2-3-5-6/h1-5H; 251356_ALDRICH; Cyclopentane, methylene- |
C6H10 |
82.14 |
C=C1CCCC1 |
|
TCMBANKIN028504 |
Allyloxybenzene |
AIDS017806; NSC4746; A35208_ALDRICH; NSC 4746; AI3-03143; Ether, allyl phenyl (8CI); ZINC01680380; Benzene, (2-propenyloxy)-; 3-Phenoxypropene; WLN: 1U2OR; Phenylpropenyl ether; Allyl phenyl ether; Usaf do-23; (allyloxy)benzene; prop-2-enoxybenzene; Ether, allyl phenyl; EINECS 217-125-3; 4-06-00-00562 (Beilstein Handbook Reference); Allyl phenoxylate; Phenyl 2-propenyl ether; InChI=1/C9H10O/c1-2-8-10-9-6-4-3-5-7-9/h2-7H,1,8H; Phenyl allyl ether; phenyl (2-propenyl) ether; BRN 1905622; 1746-13-0; AIDS-017806 |
C9H10O |
134.18 |
C=CCOC1=CC=CC=C1 |
|
TCMBANKIN028575 |
Vanillyl alcohol |
vanillyl alcohol; V 0018; AIDS017863; CHEBI:18353; 4-Hydroxy-3-methoxyphenyl methanol; Benzenemethanol, 4-hydroxy-3-methoxy-; Vanillic alcohol; W373702_ALDRICH; 4-(hydroxymethyl)-2-methoxyphenol; 175536_ALDRICH; Vanillin alcohol; Oprea1_448599; C06317; 4-Hydroxy-3-methoxybenzyl alcohol; AIDS-017863; 4-Hydroxy-3-methoxyphenylmethanol; 2-methoxy-4-methylol-phenol; 498-00-0; 4-Hydroxy-3-methoxy-benzenemethanol; AI3-24186; 4-Hydroxy-3-methoxybenzenemethanol; 4-HYDROXY-3-METHOXY-BENZYL ALCOHOL; EINECS 207-852-4; ST5330635; 4-(hydroxymethyl)-2-methoxy-phenol; NSC 3993; 55570_FLUKA; V 0018 (alcohol); c0588; NSC3993; FEMA No. 3737; 3-Methoxy-4-hydroxybenzyl alcohol; ZINC00164388 |
C8H10O3 |
154.16 |
COC1=C(C=CC(=C1)CO)O |
|
TCMBANKIN028593 |
LOF |
ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID; (S)-(−)-3-Phenyllactic acid; LLA; 3-PHENYL-LACTIC ACID; (2S)-2-hydroxy-3-phenyl-propionic acid; L-3-Phenyllactic acid; CHEBI:43065; 113069_ALDRICH; (S)-3-phenyllactic acid; L-2-HYDROXY-3-PHENYL-PROPIONIC ACID; L−(−)-3-Phenyllactic acid; (S)-2-Hydroxy-3-phenylpropionic acid; (2S)-2-hydroxy-3-phenyl-propanoic acid; (2S)-2-hydroxy-3-phenylpropanoic acid |
C9H10O3 |
166.17 |
C1=CC=C(C=C1)CC(C(=O)O)O |
|
TCMBANKIN028638 |
guggulsterol-II |
|
C27H46O3 |
418.65 |
CC(C)CCCC(C)(C1C(CC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)O)O |
|
TCMBANKIN028666 |
Methyl 4-hydroxyphenylacetate |
224502_ALDRICH; AI3-36062; methyl 2-(4-hydroxyphenyl)acetate; 2-(4-hydroxyphenyl)acetic acid methyl ester; methyl 2-(4-hydroxyphenyl)ethanoate; ST5406479; Benzeneacetic acid, 4-hydroxy-, methyl ester; Acetic acid, (p-hydroxyphenyl)-, methyl ester; ZINC00395674; 56145_FLUKA; EINECS 238-050-2; 14199-15-6 |
C9H10O3 |
166.17 |
COC(=O)CC1=CC=C(C=C1)O |
|
TCMBANKIN028759 |
Homoveratrole |
Benzene, 1,2-dimethoxy-4-methyl-; 494-99-5; NSC7378; Toluene, 3,4-dimethoxy-; EINECS 207-796-0; NSC 7378; 4-Methylveratrole; 1,2-Dimethoxy-4-methylbenzene; InChI=1/C9H12O2/c1-7-4-5-8(10-2)9(6-7)11-3/h4-6H,1-3H; 3,4-Dimethoxytoluene; 1,2-dimethoxy-4-methyl-benzene; Toluene, 3,4-dimethoxy- (8CI); 163252_ALDRICH; ZINC00388398; 38822_FLUKA; 4-Methyl-1,2-dimethoxybenzene; 4-Methylveratrol |
C9H12O2 |
152.19 |
CC1=CC(=C(C=C1)OC)OC |
|
TCMBANKIN028815 |
1,2-dimethylcycloheptene |
1,2-Dimethyl-1-cycloheptene; Cycloheptene, 1,2-dimethyl- |
C9H16 |
124.22 g/mol |
CC1=C(CCCCC1)C |
|
TCMBANKIN029417 |
ZINC02034518 |
(2S)-but-3-en-2-ol |
C4H8O |
72.11 |
CC(C=C)O |
|
TCMBANKIN029537 |
N-Methyl-L-phenylalanine hydrochloride |
02452_FLUKA |
C10H13NO2 |
179.22 |
CNC(CC1=CC=CC=C1)C(=O)O.Cl |
|
TCMBANKIN029578 |
2-Propionylfuran |
EINECS 221-693-8; 1-Propanone, 1-(2-furyl)-; Ethyl 2-furyl ketone; Furyl ethyl ketone; 2-Furyl ethyl ketone; 1-Propanone, 1-(2-furanyl)-; 1-(2-furyl)propan-1-one; 3194-15-8; NSC27357; AI3-23587; 1-furan-2-ylpropan-1-one; InChI=1/C7H8O2/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H; 1-(2-furyl)-1-propanone |
C7H8O2 |
124.14 |
CCC(=O)C1=CC=CO1 |
|
TCMBANKIN029583 |
3-methoxycinnamaldehyde |
O-Methoxycinnamaldehyde, (Z)-; Y72G543414; (Z)-2-Methoxycinnamaldehyde; UNII-Y72G543414; UNII-4940G3R6HE component KKVZAVRSVHUSPL-XQRVVYSFSA-N; ZINC12416855; 2-Propenal, 3-(2-methoxyphenyl)-; SCHEMBL9900345; KKVZAVRSVHUSPL-XQRVVYSFSA-N; NSC-114599; CJ-14057; 76760-43-5; NSC114599; 2-Propenal, 3-(2-methoxyphenyl)-, (2Z)-; (Z)-3-(2-Methoxyphenyl)acrylaldehyde; .beta.-(o-Methoxyphenyl)acrolein; cis-2-Methoxycinnamaldehyde; 2-Propenal, 3-(2-methoxyphenyl)-, (Z)- |
C10H10O2 |
162.19 |
COC1=CC=CC=C1C=CC=O |
|
TCMBANKIN030337 |
TBU |
Trimethylcarbinol; 360538_SIAL; tertiary-Butanol; AI3-01288; T-BUTYL ALCOHOL; Butanol tertiaire [French]; c0516; Methyl-2-propanol; 2-Methyl-2-propanol solution; BRN 0906698; Methanol, trimethyl-; 1,1-Dimethylethanol; Trimethyl methanol; InChI=1/C4H10O/c1-4(2,3)5/h5H,1-3H; tert-Butyl alcohol; Trimethylmethanol; 442790_SUPELCO; tert-butylalcohol; 2-Methylpropan-2-ol; 2-Methyl-2-propanol; t-Butanol; 449032_ALDRICH; tert-Butanol; 33067_RIEDEL; EINECS 200-889-7; CHEBI:26878; t-Butylalkohol; 308250_ALDRICH; NCI-C55367; B85927_SIAL; Dimethylethanol; 4-01-00-01609 (Beilstein Handbook Reference); TERTIARY-BUTYL ALCOHOL; 19460_FLUKA; t-Butyl hydroxide; tertiary alcohol; <i>tert</i>-Butyl alcohol; 471712_ALDRICH; CCRIS 4755; Caswell No. 124A; tertiary alcohols; 75-65-0; Alcool butylique tertiaire [French]; HSDB 50; t-butyl alchohol; CHEBI:45895; Arconol; Trimethyl carbinol; ZINC01680021; 50621_FLUKA; (CH3)3C-OH; tert-Butanol solution; 2-Propanol, 2-methyl- |
C4H10O |
74.12 |
CC(C)(C)O |
|
TCMBANKIN031290 |
CRS |
3-methyl-1-hydroxybenzene; CPD-112; NCGC00159366-02; C85727_ALDRICH; W353000_ALDRICH; Metacresol; Rover's Dog Shampoo; m-Kresol [German]; CHEBI:17231; Metacresol [USAN]; WLN: QR C1; hydroxy-3-methylbenzene; m-Hydroxytoluene; m-cresylic; 65996_FLUKA; InChI=1/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H; c0282; meta-cresylic acid; Caswell No. 261A; ZINC00897141; NCGC00159366-03; meta-cresol; m-toluol; m-oxytoluene; Phenol, 3-methyl-; HSDB 1815; 3-methylphenol; AI3-00136; m-Cresol [UN2076] [Poison, Corrosive]; NCGC00159366-05; 1-Methyl-3-hydroxybenzene; EINECS 203-577-9; Cresol, m-; m-cresylic acid; NSC8768; Franklin Cresolis; AIDS017739; m-Cresol, compd. With p-cresol (2:1); Metacresol (USP); 3-hydroxytoluene; CRESOL, META; Cresol, m-isomer; m-Cresole; D04951; EPA Pesticide Chemical Code 022102; NCGC00159366-04; m-methylphenol; FEMA No. 3530; 108-39-4; TOLUENE,3-HYDROXY (META-CRESOL); Celcure Dry Mix (chemicals for wood preserving); C01467; 15831-10-4; m-kresol; AIDS-017739; CCRIS 645; NSC 8768; 3-cresol; m-cresol; 1-hydroxy-3-methylbenzene; 442391_SUPELCO |
C7H8O |
108.14 |
CC1=CC(=CC=C1)O |
|
TCMBANKIN031363 |
dimethyl sulfoxide |
|
C2H6OS |
78.14 g/mol |
CS(=O)C |
|
TCMBANKIN031422 |
DICHLOROANILINE |
35160_FLUKA; Dichloroanilines, liquid [UN1590] [Poison]; 2,3-Dichloranilin; InChI=1/C6H5Cl2N/c7-4-2-1-3-5(9)6(4)8/h1-3H,9H; 608-27-5; (2,3-dichlorophenyl)amine; 36701_RIEDEL; Dichloroanilines; 2,3-Dichloroaniline; 27134-27-6; 2,3-Dichlorobenzenamine; Aniline, 2,3-dichloro-; NSC60683; NCGC00163985-01; Benzenamine, 2,3-dichloro-; Benzenamine, ar,ar-dichloro-; NSC 60683; ZINC00388504; EINECS 210-157-9; ST5406286; CHEBI:46636; HSDB 5433; Aniline, 2,3-dichloro- (7CI,8CI); Ar,ar-dichlorobenzenamine; UN1590; D55407_ALDRICH; Dichloroanilines, solid [UN1590] [Poison] |
C6H5Cl2N |
162.02 |
C1=CC(=C(C(=C1)Cl)Cl)N |
|
TCMBANKIN031636 |
Pymadin |
KBioSS_000282; CHEBI:34385; Lopac0_000032; Caswell No. 038; 4-Pyridylamine; KBio2_002850; SPBio_001486; Spectrum4_001013; Lopac-A-0152; [J.Pharmacol.Exp.Ther. 275:864 (1995)]; SPECTRUM1501130; KBio2_000282; Bio2_000282; KBio1_000572; Avitrol 200; gamma-Aminopyridine; KBio2_005418; KBioSS_000635; NSC 15041; C13728; A106; NCGC00024890-07; KBio3_000564; Philips 1861; KBio2_003203; KBio2_005771; Spectrum2_001413; p-Aminopyridine; EPA Pesticide Chemical Code 069201; KBio2_000635; Spectrum5_001501; AIDS020431; IDI1_000572; Tocris-0940; AI3-52547; Compound 1861; Pimadin (free base); NCGC00024890-04; HSDB 6037; 4 AP; RCRA waste no. P008; Bio1_000353; 4-AP; .gamma.-Aminopyridine; UPCMLD-DP125:001; Mi-W-3; NINDS_000572; KBioGR_000282; NCGC00024890-08; KBio3_001888; SBB004393; p-Aminopyridine [UN2671] [Poison]; KBio3_000563; BRN 0105782; SMR000058211; Amino-4 pyridine; EU-0100032; Fampridine (USAN); Neurelan (TN); NCGC00024890-05; Bio2_000762; Fampridine-SR; 504-24-5; Bio1_000842; A78403_ALDRICH; AIDS-020431; IDI1_034032; D04127; NCGC00024890-09; WLN: T6NJ DZ; VMI 10-3; 275875_ALDRICH; Spectrum3_000914; InChI=1/C5H6N2/c6-5-1-3-7-4-2-5/h1-4H,(H2,6,7; Avitrol; AMINOPYRIDINE; DivK1c_000572; 4-Aminopyridine; Fampridine [USAN:INN]; EINECS 207-987-9; Spectrum_000155; Neurelan; KBioGR_001505; Bio1_001331; Fampridine; EL-970; NCGC00024890-03; BSPBio_001562; AC-907/25014071; 36687_RIEDEL; Ampydin; PYRIDINE,4-AMINO; 4-Pyridinamine; VMI-10-3; pyridin-4-amine; NCGC00024890-01; Phillips 1861; SDCCGMLS-0066228.P001; Prc 1237; MLS000069400; 5-22-09-00106 (Beilstein Handbook Reference); NCGC00015009-01; NSC15041; Pyridine, 4-amino- |
C5H6N2 |
94.11 |
C1=CN=CC=C1N |
|
TCMBANKIN031702 |
M-COUMARIC ACID |
2-propenoic acid, 3-(3-hydroxyphenyl)-, (2E)-; m-coumaricacid; 3-(3-hydroxyphenyl)acrylic acid; CINNAMIC ACID,3-HYDROXY (TRANS); 2-Propenoic acid, 3-(3-hydroxyphenyl)-; 588-30-7; NSC50308; 3-(3-hydroxyphenyl)prop-2-enoic acid; (2E)-3-(3-hydroxyphenyl)acrylic acid; NSC 50308; 3-Coumaric acid; (E)-3-(3-hydroxyphenyl)acrylic acid; Cinnamic acid, m-hydroxy-; (E)-3-(3-Hydroxyphenyl)-2-propenoic acid; C12621; H23007_ALDRICH; InChI=1/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)/b5-4; (E)-3-(3-hydroxyphenyl)prop-2-enoic acid; 3-Hydroxycinnamic acid; 2-Propenoic acid, 3-(3-hydroxyphenyl)-, (E)-; trans-3-Hydroxycinnamic acid; EINECS 209-615-0; m-Hydroxycinnamic acid; trans-3-Hydroxycinnamate; NSC 28956; 28180_FLUKA; NSC28956; InChI=1/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12; m-coumaric acid; AI3-32389; 2-Propenoic acid, 3-(3-hydroxyphenyl)- (9CI) |
C9H8O3 |
164.16 |
C1=CC(=CC(=C1)O)C=CC(=O)O |
|
TCMBANKIN032380 |
salicylaldoxime |
|
C7H7NO2 |
137.14 |
C1=CC=C(C(=C1)C=NO)O |
|
TCMBANKIN033356 |
Isohomoarbutin |
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-2-methylphenoxy)tetrahydropyran-3,4,5-triol; isohomoarbutin; (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-2-methyl-phenoxy)tetrahydropyran-3,4,5-triol; (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-2-methyl-phenoxy)oxane-3,4,5-triol; (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-2-methylphenoxy)oxane-3,4,5-triol; (2S,3R,4S,5S,6R)-2-(4-hydroxy-2-methyl-phenoxy)-6-methylol-tetrahydropyran-3,4,5-triol |
C13H18O7 |
286.28 |
CC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)CO)O)O)O |
|
TCMBANKIN033625 |
2,4,6-Trimethylanisole |
2-methoxy-1,3,5-trimethylbenzene; 2-methoxy-1,3,5-trimethyl-benzene; Benzene, 2-methoxy-1,3,5-trimethyl-; Anisole, 2,4,6-trimethyl-; 4028-66-4; ZINC02598023 |
C10H14O |
150.22 |
CC1=CC(=C(C(=C1)C)OC)C |
|
TCMBANKIN033923 |
METHYLBENZOFURAN |
65850_FLUKA; Benzofuran, 2-methyl-; InChI=1/C9H8O/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6H,1H; AI3-11240; 25586-38-3; 2-methyl-1-benzofuran; EINECS 224-249-1; 224340_ALDRICH; 4265-25-2; Benzofuran, methyl-; 2-METHYLBENZOFURAN |
C9H8O |
132.16 g/mol |
CC1=CC2=CC=CC=C2O1 |
|
TCMBANKIN033980 |
Levamfetamine |
Levamfetamina [DCIT]; Levamphetamine; [(1R)-1-methyl-2-phenyl-ethyl]amine; CHEBI:42724; (R)-alpha-Methylbenzeneethanamine; PDSP2_001494; (R)-Amphetamine; EINECS 205-850-8; (2R)-1-phenylpropan-2-amine; L-Amphetamine; Phenethylamine, alpha-methyl-, (-)-; (-)-Phenylisopropylamine; Levamphetaminum; l-(R)-Amphetamine; Levamfetaminum [INN-Latin]; Benzeneethanamine, alpha-methyl-, (R)- (9CI); (R)-alpha-Methylphenethylamine; l-alpha-Methylphenethylamine; Levanfetamina [INN-Spanish]; PDSP1_001510; (-)-alpha-Methylphenethylamine; (-)-Amphetamine; 156-34-3 |
C9H13N |
135.21 |
CC(CC1=CC=CC=C1)N |
|
TCMBANKIN034135 |
cis-Zimtsaeure |
CHEBI:35699; cis-beta-carboxystyrene; (Z)-3-Phenyl-2-propenoic acid; (Z)-3-phenylprop-2-enoic acid; (2Z)-3-phenylprop-2-enoic acid; (2Z)-3-phenyl-2-propenoic acid; (2Z)-3-phenylacrylic acid; (Z)-3-phenylacrylic acid |
C9H8O2 |
148.16 |
C1=CC=C(C=C1)C=CC(=O)O |
|
TCMBANKIN034198 |
acetic acid |
AI3-02394; NSC132953; Azijnzuur [Dutch]; Acido acetico [Italian]; Essigsaeure [German]; InChI=1/C2H4O2/c1-2(3)4/h1H3,(H,3,4; Pyroligneous acid; CARBOXYMETHYL GROUP; Caswell No. 003; 45727_FLUKA; A8976_SIAL; A6283_SIAL; 64-19-7; BRN 0506007; 318590_ALDRICH; 45730_FLUKA; 77671-22-8; cellulose diacetate; Acetic acid solution, with more than 10% and less than 50% acid, by mass [UN2790] [Corrosive]; 9035-69-2; 49199_FLUKA; Cellulose diacetate [USAN]; Cellulose, diacetate; FEMA Number 2006; W200611_ALDRICH; CBM; 320099_SIAL; Methanecarboxylic acid; 45726_FLUKA; NCIOpen2_000682; Glacial acetic acid; Acetic acid (JP15/NF); ethanoic acid; 207004-55-5; Otic Tridesilon; 40209_RIEDEL; Acetic acid, propionic acid distillate; NSC406306; 537020_SIAL; 45725_FLUKA; WLN: QV1; LS-2535; Acetic acid, glacial; 27225_RIEDEL; Ethylic acid; AKOS006290339; 07692_FLUKA; ACY; NSC 132953; ACT; 33206_RIEDEL; EPA Pesticide Chemical Code 044001; 380121_SIAL; W200603_ALDRICH; Acetic acid, glacial (USP); ethoic acid; Acetic acid, glacial or acetic acid solution, >80% acid, by mass [UN2789] [Corrosive]; 34254_RIEDEL; 4-02-00-00094 (Beilstein Handbook Reference); 46928_SUPELCO; Acido acetico; C00033; Acetasol (TN); Acetic acid solution, not less than 50% but more than 80% acid, by mass [UN2790] [Corrosive]; Carboxylic acids, C2-3; CHEBI:15366; Acetic acid, of a concentration of more than 10 per cent, by weight, of acetic acid; 45732_FLUKA; Acetic acid [JAN]; Octowy kwas [Polish]; Essigsaeure; Vinegar acid; 242853_SIAL; Glacial acetic acid (JP15); 38050_RIEDEL; A9967_SIAL; LS-1541; 38051_RIEDEL; Kyselina octova [Czech]; ST5213882; Acetate standard for IC; 33209_RIEDEL; UN2790; 40273_RIEDEL; Azijnzuur; Acetic acid solution; Acetic acid (natural); D00010; LMFA01010002; 27218_RIEDEL; Acetic acid, aqueous solution; HSDB 40; 68475-71-8; 34255_RIEDEL; NCIOpen2_000659; 34256_RIEDEL; FEMA No. 2006; CCRIS 5952; Acide acetique; Acetic acid, diluted; Acetasol; Octowy kwas; 71251_FLUKA; 338826_SIAL; EINECS 200-580-7; 13669_FLUKA; Acide acetique [French]; CH3-COOH; 45754_FLUKA; 157090-22-7; Acetic acid, water solutions; UN2789 |
C5H10O3 |
118.13 |
CC(=O)NCCC1=CN(C2=C1C=C(C=C2)OC)C(=O)C3=CC=C(C=C3)Cl |
|
TCMBANKIN034214 |
ranunculin |
644-69-9; (5S)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5H-furan-2-one; C08512; (5S)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]-5H-furan-2-one; (5S)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxymethyl]-5H-furan-2-one; (5S)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]-5H-furan-2-one; Ranunculin |
C11H16O8 |
276.24 g/mol |
C1=CC(=O)OC1COC2C(C(C(C(O2)CO)O)O)O |
|
TCMBANKIN034444 |
HEPTENE |
HSDB 1078; 51856_FLUKA; EINECS 246-871-2; n-Heptene [UN2278] [Flammable liquid]; UN2278; 592-76-7; 262269_ALDRICH; 442267U_SUPELCO; EINECS 209-767-8; NSC74130; H3208_ALDRICH; 1-Heptene; hept-1-ene; Heptylene; 68526-53-4; Alkenes, C6-8, C7-rich; EINECS 271-209-4; 1-n-Heptene; 25339-56-4; n-Hept-1-ene; NSC 74130; Heptene (petroleum); Heptene (mixed cis and trans) |
C7H14 |
98.19 g/mol |
CCCCCC=C |
|
TCMBANKIN034846 |
2-methyl-5-propylfuran |
2-methyl-5-propyl-furan |
C8H12O |
124.18 g/mol |
CCCC1=CC=C(O1)C |
|
TCMBANKIN035048 |
MNN |
(S)-(-)-mandelonitrile; (-)-mandelonitrile; InChI=1/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10; (2S)-2-hydroxy-2-phenylacetonitrile; (S)-Mandelonitrile; (2S)-hydroxy(phenyl)acetonitrile; CHEBI:36941; l-mandelonitrile; (S)-Benzaldehyde cyanohydrin; (S)-MANDELIC ACID NITRILE; (2S)-2-hydroxy-2-phenyl-acetonitrile; (S)-HYDROXY(PHENYL)ACETONITRILE; C02615; (2S)-2-hydroxy-2-phenyl-ethanenitrile |
C14H17NO6 |
295.29 |
C1=CC=C(C=C1)C(C#N)O |
|
TCMBANKIN035652 |
3-Methoxyanisole |
ZINC00388167; Benzene, m-dimethoxy-; NSC8699; FEMA No. 2385; 126306_ALDRICH; W238503_ALDRICH; EINECS 205-783-4; Resorcinol dimethyl ether; AI3-00845; InChI=1/C8H10O2/c1-9-7-4-3-5-8(6-7)10-2/h3-6H,1-2H; 1,3-Dimethoxybenzene; Dimethylether resorcinolu [Czech]; 151-10-0; 28000-65-9; Benzene, 1,3-dimethoxy-; NSC 8699; Dimethyl resorcinol; Dimethylresorcinol; m-Dimethoxybenzene; 83610_FLUKA; Methoxyanisole, m- |
C8H10O2 |
138.16 |
COC1=CC(=CC=C1)OC |
|
TCMBANKIN035766 |
ACETIC ACID,BORNYL ESTER |
ZINC00404304; acetic acid [(1R,2R,4R)-1,7,7-trimethyl-2-norbornanyl] ester; [(1R,4R,6R)-1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl] acetate; bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate; [(1R,2R,4R)-1,7,7-trimethylnorbornan-2-yl] acetate; [(1R,4R,6R)-1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl] ethanoate; InChI=1/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H |
C12H20O2 |
196.29 |
|
|
TCMBANKIN036042 |
2-Methylpyrrole |
NSC81346; 1H-Pyrrole, 2-methyl-; Pyrrole, 2-methyl-; 2-Methylpyrolle; EINECS 211-255-4; .alpha.-Methylpyrrole; 2-Methyl-1H-pyrrole; 636-41-9; NSC 81346; InChI=1/C5H7N/c1-5-3-2-4-6-5/h2-4,6H,1H; 1H-Pyrrole, 2-methyl- (9CI); Pyrrole, 2-methyl- (8CI); alpha-Methylpyrrole |
C5H7N |
81.12 |
CC1=CC=CN1 |
|
TCMBANKIN036662 |
IPA |
Isopropyl alcohol (manufacturing-strong acid process only); sec-Propyl alcohol; 34965_RIEDEL; i-Propanol [German]; 278475_ALDRICH; 443425_SIAL; CHEBI:17824; Caswell No. 507; Alcool isopropilico; 563935_ALDRICH; Alcosolve 2; EPA Pesticide Chemical Code 047601; Alcool isopropylique; Takineocol; 442369_SUPELCO; c0519; NCGC00090917-01; Isopropyl alcohol [USAN]; Ethyl, 1-hydroxy-1-methyl-; Isopropanol; 92438_FLUKA; EINECS 200-661-7; Combi-schutz; N-Term LC Solvent System B; Avantine; ZINC00901159; 67-63-0; 673773_ALDRICH; sec-propanol; i-Propylalkohol [German]; AIDS-186244; 40279_RIEDEL; Secondary alcohol; 2-Hydroxypropane; BRN 0635639; LS-1565; Alcojel; D00137; Lutosol; 2-Propyl alcohol; 4-01-00-01461 (Beilstein Handbook Reference); Isopropanol (JP15); I9782_SIGMA; 1-Methylethanol; 154970_SIAL; Alcool isopropilico [Italian]; Isopropryl alcohol; 1-Methylethyl alcohol; 8013-70-5; NSC135801; HSDB 116; Isopropyl alcohol (USP); 439207_ALDRICH; 40343_RIEDEL; 34895_RIEDEL; UN1219; CCRIS 2308; WLN: QY1&1; 59309_FLUKA; Spectrar; Alkolave; FEMA No. 2929; I9516_SIGMA; Alcool isopropylique [French]; 2-Propanol : Water 31:69 with 0.1% buffer; i-Propyl alcohol; secondary alcohols; Alcolo; Alcohol, rubbing; Iso-propylalkohol; Isopropenol; Imsol A; 40314_RIEDEL; Iso-propylalkohol [German]; C01845; i-propanol; Arquad DMCB; 1-Hydroxy-1-methylethyl; Lavacol; Sterisol hand disinfectant; NSC 135801; 2-Propanol solution; Isopropyl alcohol; AI3-01636; Visco 1152; 34959_RIEDEL; 40301_RIEDEL; 91237_FLUKA; FEMA Number 2929; Isopropylalkohol; 2-PROPANOL, ISOPROPANOL; IOH; 534021_ALDRICH; Isopropyl alcohol (only persons who manufacture by the strong acid process are subject, supplier notification not required); 24137_RIEDEL; i-Propylalkohol; 190764_SIAL; Isopropyl alcohol, rubbing; CHEBI:35681; Rubbing alcohol; Isopropyl alcohol (manufacture strong-acid process); 59304_FLUKA; 34863_SIAL; Isohol; Isopro; I9030_SIGMA; 33539_RIEDEL; ST5214369; 650447_ALDRICH; Hartosol; Avantin; AIDS186244; Isopro (TN); Petrohol; 5131-95-3; 2-Propanol; W292907_ALDRICH; R-CHOH-R'; n-Propan-2-ol; Iso-propyl alcohol; Isopropanol or isopropyl alcohol [UN1219] [Flammable liquid]; Dimethylcarbinol; Propan-2-ol; InChI=1/C3H8O/c1-3(2)4/h3-4H,1-2H; Alcosolve; Propol; 675431_ALDRICH; 437522_SIAL; 40219_RIEDEL; 109827_ALDRICH |
C3H8O |
60.1 |
CC(C)O |
|
TCMBANKIN036840 |
protocatechuic acid |
3,4-Dihydroxybenzoic acid; MLS000737807; c0120; 4-Carboxy-1,2-dihydroxybenzene; InChI=1/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11; NSC 16631; ZB000710; Benzoic acid, 3,4-dihydroxy-; 4,5-dihydroxybenzoate; 3,4-dihydrobenzoic acid; DHB; DB03946; AC1N59J2; CCRIS 6291; AIDS082396; Protocatehuic acid; BRN 1448841; protocatechuicacid; 3,4-dihydroxybenzoate; SMR000528167; D-3487; EINECS 202-760-0; 4,5-Dihydroxybenzoic acid; C00230; Catechol-4-carboxylic Acid; 3,4-DHBA; Protocatechuic acid polymer; CHEBI:36241; 2buv; 4-10-00-01459 (Beilstein Handbook Reference); AIDS-082396; 99-50-3; A846038; AIDS002961; Oxidative polymer of protocatechuic acid; 37580_FLUKA; AIDS-002961; 1ykp; Benzoic acid, 3,4-dihydroxy- (9CI); NSC16631; 3,4-bis(oxidanyl)benzoate; CHEBI:36062; 3, 4-Dihydroxybenzoic acid; TULIP017459 |
C18H14O8 |
358.299 |
c12c(O[C@]([H])(c3c([H])c([H])c(O[H])c(O[H])c3[H])[C@@]1([H])C(=O)O[H])c(O[H])c([H])c([H])c2\C([H])=C([H])\C(O[H])=O |
|
TCMBANKIN038346 |
Sagittatoside B |
|
C32H38O13 |
631 |
c1(O[H])c(C([H])([H])\C([H])=C(/C([H])([H])[H])\C([H])([H])[H])c(OC(c2c([H])c([H])c(C([H])([H])[H])c([H])c2[H])=C(O[C@@]3([H])O[C@]([H])(C([H])([H])[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@]3([H])O[C@@]4
([H])OC([H])([H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]4([H])O[H])C5=O)c5c(O[H])c1[H] |
|
TCMBANKIN038837 |
n-methyltyramine |
Methyl-4-tyramine; 370-98-9; N-methyltyraminium cation; C02442; 4-(2-methylaminoethyl)phenol; Phenol, 4-(2-(methylamino)ethyl)- (9CI); A823530; p-(2-(Methylamino)ethyl)phenol; 4-[2-(methylamino)ethyl]phenol; CHEBI:58155; PHENOL, p-(2-METHYLAMINOETHYL)-; N-methyltyraminium; Phenol, p-[2-(methylamino)ethyl]-; BRN 2357129; NMT; N-Methyltyramine; 2-(4-hydroxyphenyl)ethyl-methylammonium; WIN 5582; 2-(4-hydroxyphenyl)ethyl-methyl-azanium; NSC113958; p-[2-(Methylamino)ethyl]phenol; Tyramine, N-methyl-; p-(2-Methylaminoethyl)phenol; EINECS 206-731-3; 4-13-00-01790 (Beilstein Handbook Reference); 4-Hydroxy-N-methylphenethylamine; CHEBI:17458; N-methyltyraminium(1+); NSC 113958; Phenol, 4-[2-(methylamino)ethyl]-; 2-(4-hydroxyphenyl)-N-methylethanaminium |
C9H13NO |
151.21 |
CCC(C)C(=O)N |
|
TCMBANKIN039128 |
Isofucosterol |
C08812; (3S,8S,9S,10R,13R,14S,17R)-17-[(Z,1R)-4-isopropyl-1-methylhex-4-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol; C08821; AIDS113090; 481-14-1; isofucosterol; (3S,8S,9S,10R,13R,14S,17R)-17-[(Z,1R)-4-isopropyl-1-methyl-hex-4-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol; AIDS-113090; (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol; 18472-36-1; delta5-Avenasterol |
C29H48O |
412.69 |
CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C |
|
TCMBANKIN039283 |
m-Ethylphenol |
FT-0628787; DSSTox_CID_2480; 3-Ethylphenol, >=95.0% (GC); MFCD00002311; Phenol, m-ethyl- (8CI); MCULE-6091136568; CHEMBL58052; TL8004015; SCHEMBL51757; DB-030920; KB-31678; KB-203153; 281417_ALDRICH; 3-Ethylphenol 100 microg/mL in Methanol; ACMC-209myx; ANW-34039; CAS-620-17-7; Phenol, m-ethyl-; 04688_FLUKA; InChI=1/C8H10O/c1-2-7-4-3-5-8(9)6-7/h3-6,9H,2H2,1H; ALBB-026446; 3-ETHYL PHENOL; Benzene, 1-ethyl-3-hydroxy-; AI3-19938; 3-Ethyl-phenol; 3-Ethylphenol; BIDD:ER0180; NSC-8873; ST24042146; CHEBI:34332; NSC8873; UNII-C27Y543KVA component HMNKTRSOROOSPP-UHFFFAOYSA-N; 3-ETHYLPHENOL; DTXSID0022480; DSSTox_RID_76600; UNII-0G9ZK222JX; NCGC00249086-01; NCGC00256388-01; AC1Q2TW6; HMNKTRSOROOSPP-UHFFFAOYSA-N; Tox21_302992; 3-Ethylphenol, technical grade, 80%; I01-7336; LS-179861; AK-76825; m-Ethyl phenol; MolPort-001-791-375; KS-000010X9; 3-Ethylphenol, PESTANAL(R), analytical standard; AKOS000120810; Ambap620-17-7; 0G9ZK222JX; KSC238O1R; SC-27057; 36723_RIEDEL; AN-21981; PubChem10772; CJ-05938; C14386; Q-200377; 3-Ethylphenol, 99%; Phenol, 3-ethyl-; EINECS 210-627-3; CJ-26655; HSDB 5720; ZINC01648289; NCGC00259172-01; E0161; 620-17-7; AJ-28742; RT-000967; RP19475; m-ethylphenol; 1-Ethyl-3-hydroxybenzene; AS04468; AC1L1YUL; STL481945; DSSTox_GSID_22480; A8582; Tox21_201623; ZINC1648289; 1-Hydroxy-3-ethylbenzene; NSC 8873; meta-Ethylphenol |
C8H10O |
122.16 |
CCC1=CC(=CC=C1)O |
|
TCMBANKIN041080 |
β-amyrin acetate |
Acetic acid oleana-12-ene-3alpha-yl ester; b—Amyrin-acetate; beta-amyrin acetate; 3β-O-acetoxyolean-12-en- 28-oic acid; β- amyrin acetate; beta-amyrin acetate ; beta-Amyrin acetate |
C32H52O2 |
468.75 |
CC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CC=C4C3(CCC5(C4CC(CC5)(C)C)C)C)C)C |
|
TCMBANKIN043152 |
Amygdalinic acid |
|
C20H28O13 |
476 |
c1([H])c([H])c([H])c([C@]([H])(O[C@]2([H])O[C@]([H])(C([H])([H])O[C@@]3([H])O[C@@]([H])(C([H])([H])O[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]3([H])O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]2([H])O[H])C(O
[H])=O)c([H])c1[H] |
|
TCMBANKIN043270 |
p-Coumaric acid |
CHEBI:32373; Para-Coumaric acid; ZB001183; trans-4-Hydroxycinnamic acid; (E)-3-(4-Hydroxyphenyl)-2-propenoic acid; 2-propenoic acid, 3-(4-hydroxyphenyl)-, (2E)-; Naringeninic acid; p-Cumaric acid; CHEBI:36090; p-Coumaric acid,trans; 501-98-4; (E)-3-(4-hydroxyphenyl)acrylic acid; trans-4-coumarate; 4'-Hydroxycinnamic acid; 4-(2-Carboxyethenyl)phenolate; HC4; trans-4-hydroxycinnamate; trans-p-Coumarinic acid; 4-hydroxycinnamate anion; 3-(4-hydroxyphenyl)acrylic acid; (2E)-3-(4-hydroxyphenyl)prop-2-enoic acid; 3-(4-hydroxyphenyl)prop-2-enoate; trans-p-Hydroxycinnamic acid; (E)-3-(4-hydroxyphenyl)prop-2-enoate; (E)-p-Hydroxycinnamic acid; 3-(4-hydroxyphenyl)acrylate; trans-4-coumaric acid; trans-p-Coumaric acid; (2E)-3-(4-hydroxyphenyl)acrylate; 4-10-00-01005 (Beilstein Handbook Reference); C00811; (2E)-3-(4-hydroxyphenyl)acrylic acid; BRN 2207383; CHEBI:12876; beta-(4-Hydroxyphenyl)acrylic acid; Para coumaric acid; COUMARATE; MLS001066419; 28200_FLUKA; p-Hydroxyphenylacrylic acid; Cinnamic acid, p-hydroxy-; 4-Coumaric acid; InChI=1/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12; 7400-08-0; beta-[4-hydroxyphenyl]acrylic acid; A828008; p-coumaricacid; SBB007613; 4-Hydroxycinnamate; Cinnamic acid, p-hydroxy-, (E)-; SMR000112201; 0-10-00-00297 (Beilstein Handbook Reference); CINNAMIC ACID,4-HYDROXY P-COUMARIC ACID; (E)-p-Coumaric acid; AIDS027710; CJ-00262; (2E)-3-(4-hydroxyphenyl)prop-2-enoate; 2-Propenoic acid, 3-(4-hydroxyphenyl)-; ZINC00039811; .beta.-[4-Hydroxyphenyl]acrylic acid; p-coumaric acid ; AC1NRBN2; InChI=1/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3; trans-p-coumarate; (E)-3-(4-hydroxyphenyl)prop-2-enoic acid; 4-Oxylatocinnamate; p-Hydroxycinnamic acid; HYDROXYCINNAMIC ACID; EINECS 231-000-0; BRN 2207381; NSC 674321; Enamine_005378; 4-Hydroxycinnamic acid; CHEBI:32374; NSC674321; AIDS-027710; 2-Propenoic acid, 3-(4-hydroxyphenyl)-, (E)- (9CI); NSC59260; p-coumarate; (E)-3-(4-hydroxyphenyl)-2-propenoate; C9008_SIGMA; 3-(4-Hydroxyphenyl)-2-propenoic acid; 3-(4-hydroxyphenyl)prop-2-enoic acid; 4-coumarate; NSC 59260 |
C9H8O3 |
164.158 |
c1([H])c([H])c(O[H])c([H])c([H])c1\C([H])=C([H])\C(=O)O[H] |
|
TCMBANKIN044727 |
salicylic acid |
3320-EP2298732A1; D00097; CCRIS 6714; 3320-EP2287148A2; 3320-EP2298735A1; o-Hydroxybenzoate anion; Trans-Ver-Sal; Verrugon; CHEBI:30762; STK258681; 2y7w; salicylate; BBL000698; 3320-EP2305260A1; 3320-EP2311796A1; K 537; Keralyt; AC1L1JPL; Salicylate anion; 3320-EP2301534A1; Orthohydroxybenzoic acid; 3320-EP2292595A1; o-hydroxybenzoic acid; Salicylate ion; 3320-EP2298777A2; ACS No 10; Ionil; 3320-EP2289871A1; Salicylic acid [USAN:JAN]; 3320-EP2298748A2; SMR000059163; AC1Q5BFS; o-Carboxyphenol; NCGC00178624-02; 3320-EP2269991A2; 25496-36-0; 3320-EP2292614A1; 3320-EP2311451A1; Salicylic acid; YGSDEFSMJLZEOE-UHFFFAOYSA-M; 3320-EP2284179A2; Benzoic acid, 2-hydroxy-; 3320-EP2287150A2; MLS000069653; 3320-EP2301912A2; CHEBI:16914; Ionil-Plus; Salicylic acid & Sulfur Soap; 3320-EP2305637A2; 3320-EP2298743A1; 3320-EP2284151A2; 54-21-7 (SODIUM SALT); AB00053542_03; Salicylic acid collodion; Kyselina 2-hydroxybenzoova [Czech]; Salicylic acid (6CI,8CI); AIDS-006789; 3320-EP2295416A2; KBio2_003996; 2-hydroxy-benzoate; Dr. Scholl's Corn Removers; 3320-EP2284152A2; Advanced Pain Relief Corn Removers; 3320-EP2284156A2; NCGC00159447-02; 3320-EP2316835A1; 3320-EP2295413A1; 3320-EP2308863A1; 3320-EP2292593A2; 3320-EP2305671A1; AIDS006789; Duofil Wart Remover; 2-Hydroxybenzoic acid; 3gf2; InChI=1/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10; 3320-EP2269985A2; C00805; 3twp; 3320-EP2311798A1; 3320-EP2275420A1; hydroxybenzoate; WLN: QVR BQ; Salonil; S7401_SIGMA; NSC 180; Salicylic acid (JP15/USP); 3320-EP2301927A1; 3198-EP2289876A1; 3320-EP2316470A2; NCGC00178624-03; Saligel; 2-HYDROXYPHENYLFORMATE; salicylicacid; CPD-110; 3320-EP2284150A2; Spectrum_000948; EPA Pesticide Chemical Code 076602; 3320-EP2284164A2; 3320-EP2295550A2; SMP2_000145; Acidum salicylicum; CAS_54-21-7; Dr. Scholl's Callus Removers; Stri-Dex; ZB000360; SAL; o-Hydroxybenzoate; 3320-EP2280008A2; Clear away Wart Remover; 3320-EP2295432A1; S8519_SIGMA; CTK5I4917; CJ-00055; Salicylic acid, tech.; Salicylic acid soap; 3320-EP2269978A2; 2-Hydroxybenzoate (Na+); Benzoic acid, 2-hydroxy-, ion(1-); SGCUT00012; Duoplant; Freezone; 3320-EP2284155A2; Occlusal; 3320-EP2284178A2; 3320-EP2301914A1; 3320-EP2311825A1; MFCD00984876; Psoriacid-S-Stift; 3320-EP2301913A1; Rutranex; IDI1_000301; 3320-EP2314578A1; 2-Hydroxybenzenecarboxylic acid; 3320-EP2298765A1; 3320-EP2308832A1; MolPort-003-710-545; 8052-31-1; o-Hydrobenzoate; Retarder W; Salicylic acid-ring-UL-14C; 2y7k; Duofilm; o-Hydrobenzoic Acid; NSC_5900; EINECS 200-712-3; NCGC00159447-04; BDBM85513; 3320-EP2295419A2; 3320-EP2314295A1; STK372903; 63-36-5; 3320-EP2311835A1; DivK1c_000301; 2-Hydroxybenzoic acid ion(1-); 3320-EP2316450A1; 3320-EP2277875A2; Dr. Scholl's Wart Remover Kit; 105910_ALDRICH; HSDB 672; 69-72-7; 3320-EP2311842A2; 2y7p; 3320-EP2284153A2; AI3-02407; 3320-EP2272847A1; 7681-06-3; Phenol-2-carboxylic acid; AKOS005447222; 3198-EP2298777A2; Ionil Plus; KBioSS_001428; 3320-EP2301916A2; T7104; 3320-EP2284170A1; 3320-EP2298764A1; Caswell No. 731; 2-Oxylatobenzoate; 84210_FLUKA; KBio1_000301; 3320-EP2311799A1; BENZOIC ACID,2-HYDROXY SALICYLIC ACID; to_000004; Compound w; 3320-EP2275102A1; 3320-EP2311797A1; 2-Hydroxybenzoate; Kyselina salicylova [Czech]; S5922_SIGMA; 3320-EP2287140A2; 2-Hydroxybenzoic acid anion; 3320-EP2305688A1; 3320-EP2305243A1; UPCMLD-DP126:001; 3320-EP2295412A1; 27301_SIAL; Salicylic acid, ion(1-); 3320-EP2292590A2; 3320-EP2277876A1; W398500_ALDRICH; Oprea1_040343; KBio2_006564; Salicylic acid (TN); Sebucare; 2-Carboxyphenol; Benzoic acid, 2-hydroxy- (9CI); Acido salicilico [Italian]; KBio2_001428; Acido o-idrossibenzoico [Italian]; Advanced Pain Relief Callus Removers; LS-144344; NINDS_000301; 2-hydroxybenzoic acid; 247588_SIAL; 2-CARBOXYBENZENOLATE; 3198-EP2314295A1; NSC180; Domerine; Sebulex; BRN 0774890; CMC_13852 |
C7H6O3 |
138.12 |
C1=CC=C(C(=C1)C(=O)O)[O-] |
|
TCMBANKIN045638 |
beta-Sitosterol-3-O-beta-D-xylopyranoside |
AC1O3E0X; beta-sitosterol-3-o-beta-d-xylopyranoside; (2S,3R,4S,5R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol; β-sitosterol-3-o-β-d-xylopyranoside; beta-Sitosterol-3-O-beta-D-xylopyranoside_qt |
|
546.92 |
|
|
TCMBANKIN045922 |
indole |
Benzopyrrole; Indol; W259306_ALDRICH; ZINC00895236; INDOLE BENZO-PYRROLE; 783272-65-1; 1H-Indole (9CI); 1H-Indole-1-cation; Benzo[b]pyrrole; 2,3-Benzopyrrole; 2,3-Benzopyrole; NSC 1964; CHEBI:16881; Indole (natural); 1H-Benzo[b]pyrrole; CCRIS 4421; InChI=1/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9; KB-274206; 1H-indol-1-ium; 1H-Indol-1-iumyl; 269077_ALDRICH; NSC1964; 1-Azaindene; SB 00587; 442619_SUPELCO; Ketole; SIKJAQJRHWYJAI-UHFFFAOYSA-O; AC1NC5DJ; INDOLE; AI3-01540; Indol [German]; 57190_FLUKA; 1-Benzo(b)pyrrole; LS-2832; WLN: T56 BMJ; IND; Caswell No. 498B; EINECS 204-420-7; 1-Benzazole; 1H-Indole; EPA Pesticide Chemical Code 025000; FEMA No. 2593; HSDB 599; 120-72-9; Indole (8CI); C00463; I3408_ALDRICH; indolium |
C8H7N |
117.148 |
n1([H])c(c([H])c([H])c([H])c2[H])c2c([H])c1[H] |
|
TCMBANKIN047824 |
Homovanillyl alcohol |
4-Hydroxy-3-methoxyphenethanol; homovanillyl alcohol; EINECS 219-175-1; 3-METHOXY-4-HYDROXYPHENYLETHANOL; 4-Hydroxy-3-methoxyphenethyl alcohol; Benzeneethanol, 4-hydroxy-3-methoxy-; 148830_ALDRICH; ZINC00388293; 4-(2-hydroxyethyl)-2-methoxyphenol; 4-(2-hydroxyethyl)-2-methoxy-phenol; 4-Hydroxy-3-methoxyphenylethyl alcohol; 4-(2-Hydroxyethyl)guaiacol; 2380-78-1; ST5406563 |
C9H12O3 |
168.19 |
COC1=C(C=CC(=C1)CCO)O |
|
TCMBANKIN054848 |
Valerianae alkaloid B |
phenyl pyruvicacid;PPY;CHEBI:30851; PHENYL-PYRUVATE; phenylpyruvate; 156-06-9; keto-phenylpyruvate; alpha-oxo-benzenepropanoic acid; SBB012361; AIDS167235; 2-Oxo-3-phenylpropanic acid; Benzenepropanoic acid, .alpha.-oxo-; Benzenepropanoic acid, alpha-oxo-; beta-phenylpyruvic acid; 3-Phenylpyruvic acid; 2-keto-3-phenyl-propionic acid; 286958_ALDRICH; 1PY; Phenyl pyruvic acid; C00166; alpha-ketohydrocinnamic acid; Pyruvic acid, phenyl-; keto-phenylpyruvic acid; 3-phenyl-2-oxopropanoate; 2-oxo-3-phenylpropanoic acid; 2-oxo-3-phenyl-propanoic acid; EINECS 205-847-1; Phenylbrenztraubensaeure; AIDS-167235; phenylpyruvic acid; 2-OXO-3-PHENYLPROPIONIC ACID; 3-phenyl-2-oxopropanoic acid |
C18H23ClNO2 |
|
C1([H])=N(C([H])([H])C([H])([H])c2c([H])c([H])c(O[H])c([H])c2[H])C([H])=C(C([H])([H])O[H])C3=C1[C@@]([H])(C([H])([H])[H])C([H])([H])C3([H])[H].Cl |
|
TCMBANKIN057916 |
MCT |
NSC 17489; M34200_ALDRICH; p-Methylcatechol; BRN 0636512; Homocatechol; Homopyrocatechol; AIDS002963; AIDS-002963; 4-Methylpyrocatechol; 3,4-Dihydroxytoluene; Pyrocatechol, 4-methyl-; 4-Methyl-1,2-benzenediol; 452-86-8; NSC17489; Toluene-3,4-diol; 4-Methylcatechol; 4-Methyl-1,2-dihydroxybenzene; ZINC00002500; InChI=1/C7H8O2/c1-5-2-3-6(8)7(9)4-5/h2-4,8-9H,1H; CHEBI:17254; 53480_FLUKA; EINECS 207-214-5; 1,2-Benzenediol, 4-methyl- (9CI); C06730; SMR000471857; p-Methylpyrocatechol; 1,2-Benzenediol, 4-methyl-; c0126; 1,2-Dihydroxy-4-methylbenzene; CCRIS 3333; 4-methylbenzene-1,2-diol; MLS001066329 |
C7H8O2 |
124.14 |
C(=O)([O-])[O-].[Ca+2] |
|
TCMBANKIN057919 |
2(R)-(3,4-dimethoxy-phenyl)-propanel,3-diol-l-O-β-D-glucopyranoside |
formic acid;fatty acids;FMT;saturated fatty acids;formicacid; methanol peroxide; Dioxirane-3-ol;251364_SIAL; 64-18-6; 27001_RIEDEL; HCOOH; Kyselina mravenci [Czech]; methoic acid; 06473_FLUKA; Spirit of formic acid; Formira; CBX; RCRA waste no. U123; Formylic acid; Methanoic acid; 09676_FLUKA; Formic acid (natural); C1 acid; CCRIS 6039; 49897_FLUKA; 7056-83-9; Kwas metaniowy [Polish]; Bilorin; Myrmicyl; RCRA waste number U123; Ameisensaeure [German]; F0507_SIAL; Collo-didax; EINECS 200-579-1; UN1779; C00058; Add-F; InChI=1/CH2O2/c2-1-3/h1H,(H,2,3; 33015_RIEDEL; 82069-14-5; H-COOH; Collo-bueglatt; LMFA01010040; 94318_FLUKA; AI3-24237; Wonderbond Hardener M 600L; HSDB 1646; Mierenzuur [Dutch]; formic acid; 06450_FLUKA; Sybest; Formic acid solution; FEMA No. 2487; Formisoton; CHEBI:30751; Ameisensaeure; 399388_SIAL; ST5214364; 8006-93-7; Ameisensaure; Formate standard for IC; CARBOXY GROUP; LS-1540; Methanoic acid monomer; Formic acid [UN1779] [Corrosive]; W248703_ALDRICH; Acide formique [French]; Aminic acid; Acido formico [Italian]; 06460_FLUKA; 15907-03-6; Hydrogen carboxylic acid; EPA Pesticide Chemical Code 214900; 56302_FLUKA |
HCOOH or CH2O2 |
46.025 g/mol;46.03 |
C(=O)O |
|
TCMBANKIN057949 |
sucrose |
Amerfand; 29253-78-9; Sucrose (TN); alpha-D-Glucopyranoside, beta-D-fructofuranosyl-; saccharose; Sugar, compressible (NF); S0389_SIGMA; D06530; C00089; 1-alpha-D-Glucopyranosyl-2-beta-D-fructofuranoside; Sucrose, purified; 8027-47-2; 30027-72-6; 29764-06-5; 86101-30-6; NSC 406942; D06529; Sucrose [USAN:JAN]; 146187-04-4; ST5308554; Sugar, confectioner's; D(+)-Saccharose; S7903_SIGMA; GLC-(1-2)FRU; alpha-D-glucopyranosyl beta-D-fructofuranoside; FICOLL; 151756-02-4; Sugar spheres (NF); White soft sugar (JP15); Sucraloxum [INN-Latin]; Saccharum; alpha-D-Glc-(1-2)-beta-D-Fru; S9378_SIGMA; 76056-38-7; 47289_SUPELCO; D-Sucrose; Sugar spheres; 87430-66-8; 104242-10-6; (alpha-D-Glucosido)-beta-D-fructofuranoside; Table sugar; Sacharose; (2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol; NCI-C56597; 47167-52-2; CCRIS 2120; alpha-D-Glucopyranoside, beta-D-fructofuranosyl, homopolymer; D06528; Microse; Cane sugar; Amerfond; 64533-66-0; White soft sugar; beta-D-Fruf-(2<->1)-alpha-D-Glcp; sugar; White sugar; SUC; 84097_FLUKA; Rock candy; beta-D-Fructofuranosyl-alpha-D-glucopyranoside; Fructofuranoside, alpha-D-glucopyranosyl, beta-D; 80165-03-3; 47257-91-0; CHEBI:17992; 47185-09-1; S5390_SIGMA; alpha-D-Glucopyranoside, beta-D-fructofuranosyl; S1888_SIGMA; 220376-22-7; D06533; 8030-20-4; S3929_SIGMA; S1174_SIGMA; 65545-99-5; Glucopyranoside, beta-D-fructofuranosyl, alpha-D; S2395_SIGMA; 78654-77-0; D06531; (2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol; SUCROSE; S5016_SIAL; 51909-69-4; 85456-51-5; D()-Saccharose; ZINC04217475; 84100_FLUKA; D00025; Confectioner's sugar; EINECS 200-334-9; Sugar, confectioner's (NF); 57-50-1; 100405-08-1; 92004-84-7; Beet sugar; S5391_SIGMA; Sucrose, dust; alpha-D-Glc-(1->2)-beta-D-Fru; beta-D-Fructofuranosyl alpha-D-glucopyranoside; 131932-12-2; HSDB 500; Sugar, compressible; AI3-09085; alpha-D-Glucopyranosylbeta-D-fructofuranoside; Rohrzucker; 16104_RIEDEL; (2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-dimethylol-tetrahydrofuran-2-yl]oxy-6-methylol-tetrahydropyran-3,4,5-triol; Granulated sugar; S8501_SIGMA; Sucrose, purified (JAN); 146054-35-5; Sucrose (JP15/NF); 9012-95-7; Sucrose, pure; 75398-84-4; 50857-68-6; (2R,3R,4S,5S,6R)-2-[[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)-2-tetrahydrofuranyl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol; 25702-74-3; D(+)-Sucrose |
C12H22O11 |
342.3 g/mol |
C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O |
|
TCMBANKIN057960 |
glutathion |
glutathione |
C10H17N3O6S |
307.33 g/mol |
C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)N |
|
TCMBANKIN057965 |
arginine |
L(+ )-arginine;EINECS 230-571-3; (2S)-2-amino-5-guanidino-pentanoic acid; EINECS 200-811-1; (S)-2-Amino-5-guanidinovaleric acid; DL-Arginine; (L)-Arginine; Arginine hydrochloride(USAN); 1-Amino-4-guanidovaleric acid; L-Ornithine, N5-(aminoiminomethyl)-; W381918_ALDRICH; (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid; Arginine [USAN:INN]; S-(+)-2-Amino-5-[(aminoiminomethyl)amino]pentanoic acid; L-Arginine, labeled with tritium; AI3-24165; AIDS-121865; (S)-2-Amino-5-[(aminoiminomethyl)amino]pentanoic acid; NSC203450 (HYDROCHLORIDE); A5006_SIAL; (+-)-Arginine; L-Norvaline, 5-((aminoiminomethyl)amino)-; AIDS121865; Lopac0_000077; Tocris-0663; Arginine (VAN); 4455-52-1; CCRIS 3609; BRN 1725413; NCGC00015064-01; (2S)-2-amino-5-(carbamimidamido)pentanoic acid; (2S)-2-amino-5-guanidinopentanoic acid; D02982; Argininum [INN-Latin]; C00062; 7200-25-1; A8094_SIGMA; 11009_FLUKA; Poly(L-arginine); (2S)-2-amino-5-guanidino-valeric acid; Lopac-A-5006; NSC 206269; HSDB 1429; CHEBI:16467; L-Arginine, homopolymer; L-Arginine (9CI); Arginina [INN-Spanish]; 4-04-00-02648 (Beilstein Handbook Reference); (S)-2-amino-5-guanidinopentanoic acid; (S)-2-Amino-5-((aminoiminomethyl)amino)pentanoic acid; Arginine, L- (8CI); L-Arginine (JP15); EU-0100077; L-alpha-Amino-delta-guanidinovaleric acid; NSC7914 (HYDROCHLORIDE); Arginine (USP); 1119-34-2 (HYDROCHLORIDE); Pentanoic acid, 2-amino-5-((aminoiminomethyl)amino)-, (S)-; L-Arg; L-Norvaline, 5-[(aminoiminomethyl)amino]-; 142-49-4; A4474_SIAL; InChI=1/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s; L-Arginin; Arginine, DL-; NCGC00024715-01;AC1ODX8E; [(4S)-5-amino-4-azaniumyl-5-oxopentyl]-(diaminomethylidene)azanium; [AMINO({[(4S)-4-AMMONIO-4-CARBAMOYLBUTYL]AMINO})METHYLIDENE]AZANIUM |
C6H14N4O2 |
174.2 g/mol |
C(CC(C(=O)O)N)CN=C(N)N |
|
TCMBANKIN058004 |
trigonelline |
Prestwick_70; N-Methylnicotinic acid betaine hydrochloride; 1-methyl-3-pyridin-1-iumcarboxylate hydrochloride; MFCD00077250; SCHEMBL468365; A833196; trigonelline ; trigonelline HCl; 1-methylpyridin-1-ium-3-carboxylate hydrochloride; AC1O4WFS; 1-Methylpyridinium-3-carboxylate hydrochloride; T-6500; CHEMBL489961; trigonellin; gynesine; trigonelline |
C7H7NO2 |
137.14 g/mol |
C[N+]1=CC=CC(=C1)C(=O)[O-] |
|
TCMBANKIN058025 |
styrene |
105270-05-1; cinnamene; phenyl-ethylene; 61584-90-5; C19506; PPBRXRYQALVLMV-UHFFFAOYSA-N; 81415_FLUKA; 5487-EP2277945A1; MFCD00084450; CJ-04646; 52932-49-7; Benzene, ethenyl-, homopolymer; 20215_SUPELCO; Polystyrene, atactic; InChI=1/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H; S4972_SIAL; 81413_FLUKA; 51609-87-1; Styrene, analytical standard; AKOS000119972; Polystyrene standard, M.W. 1,300, Mw/Mn 1.06; 182435_ALDRICH; viny lbenzol; Chromosorb 102,100/120 50G; S0651; 9055-91-8; Polystyrene latex microsphere, 0.05 micron, 2.5 wt% dispersion in water; 189596_ALDRICH; 61584-89-2; 37291-EP2311803A1; Polysorb; 379514_ALDRICH; 00945_FLUKA; 79637-11-9; 5487-EP2269995A1; 5487-EP2295426A1; Cinnamene; 172641-48-4; 730985-59-8; NCGC00091056-01; 5487-EP2309584A1; CCRIS 564; 81406_FLUKA; AI3-24374; 81412_FLUKA; 117294-EP2287158A1; 78354-47-9; 1191987-17-3; 110866-50-7; W323306_ALDRICH; Benzene, ethenyl-, homopolymer, hydrogenated; Polystyrene standard, M.W. 2,200, Mw/Mn 1.06; UN 2055 (Salt/Mix); 149212-19-1; 100-42-5; Vinylbenzene, inhibited; Cinnamenol; 1263545-74-9; 5487-EP2305686A1; Styrene 5000 ng/microl in Methanol; Ethenylbenzene; 373601-20-8; Polystyrene latex microsphere, 1 micron, 2.5 wt% dispersion in water; Phenethylene; FT-0689054; Polystyrene standard, M.W. 13,000, Mw/Mn 1.06; Styrene, SAJ first grade, >=99.0%; Styrol [German]; Polystyrene latex microsphere, fluorescent, 6.0 micron, 2.5 wt% dispersion in water; 58033-91-3; Styren; CHEBI:27452; MALDI validation set polystyrene Mp 500-70'000 certified according to DIN; 5487-EP2295415A1; Styrene Resin (Med.M.Wt.); Polystyrene latex microsphere, 10.0 micron, 2.5 wt% dispersion in water; 327808_ALDRICH; Chromosorb 106, 60/80 MESH, 50GM; 171022-09-6; Styrene polymer; 461733_ALDRICH; 03565_FLUKA; Styren [Czech]; 851588-70-0; NCGC00091056-03; Polystyrene standard, M.W. 30,000, Mw/Mn 1.06; DTXSID2021284; 00928_FLUKA; 5487-EP2298313A1; Polystyrene high Mol. Wt.; 40494-15-3; 5487-EP2275418A1; Styropor (Salt/Mix); RP18837; 55465-00-4; 5487-EP2287168A2; 12770-88-6; 81418_FLUKA; Styrene, 99.5% stab. with 4-tert-Butylcatechol; 81402_FLUKA; 131495-39-1; 5487-EP2270113A1; 11120-46-0; KSC176E4F; 81834-12-0; Polystyrene (100-200 mesh, PEG crosslinked); PhCH=CH2; Styropol (Salt/Mix); 327794_ALDRICH; Styrene 100 microg/mL in Methanol; Vinylbenzol; Styropol SO; Phenylethene; Vinylbenzen [Dutch]; 459364_ALDRICH; NSC-62785; Benzene, ethenyl-; Styron; Cinnaminol; 5487-EP2289883A1; Styrene solution; CHEMBL285235; 1161074-30-1; Chromosorb 103; Stirolo [Italian]; Benzene-1,2,3,4,5-d5, 6-(ethenyl-1,2,2-d3)-; 53112-49-5; 5487-EP2289896A1; EINECS 273-493-5; Tox21_200808; Polystyrene latex microsphere, 2 micron, 2.5 wt% dispersion in water; 81407_FLUKA; 5487-EP2305685A1; Styrene monomer, inhibited; Vinyl benzene; 157929-02-7; Polystyrene latex microsphere, 20.0 micron, 2.5 wt% dispersion in water; 54596-41-7; 20202_SUPELCO; Ethylene, phenyl-; 5487-EP2280014A2; Styrene, 99%, stabilized 100ml; 5487-EP2380568A1; NCGC00091056-02; 00953_FLUKA; 1083095-63-9; W550159_ALDRICH; Polystyrene solution; Annamene; Chromosorb 101; 25038-60-2; 2-phenylethenyl; Polystyrene latex microsphere, 4.5 micron, 2.5 wt% dispersion in water; 00949_FLUKA; Polystyrene standard, M.W. 290,000, Mw/Mn 1.06; 68987-41-7; Ethylbenzene alkylate; 143365-EP2292620A2; Styreen; 86090-91-7; 327719_ALDRICH; 219782-52-2; 441772-62-9; 53986-84-8; 5487-EP2380867A1; 487021-46-5; 359762-95-1; Polystyrene latex microsphere, 6.0 micron, 2.5 wt% dispersion in water; KB-60631; 117294-EP2298762A2; 25086-18-4; 53395_FLUKA; 00946_FLUKA; 57657-06-4; 726192-11-6; Tox21_113245; 5487-EP2301924A1; NSC 62785; BIDD:ER0247; 39470-87-6; 143365-EP2287165A2; Polystyrene latex microsphere, 0.20 micron, 2.5 wt% dispersion in water; Polystyrene latex microsphere, 25.0 micron, 2.5 wt% dispersion in water; DSSTox_RID_76057; Phenylethylene, inhibited; 327824_ALDRICH; EC 202-851-5; 1198090-46-8; AC1Q2AAB; Polystyrene latex microsphere, 15.0 micron, 2.5 wt% dispersion in water; 5487-EP2311804A2; Polystyrene,flame retarding and impact resistant; 5487-EP2308832A1; 51876_FLUKA; 68441-35-0; Vinyl-benzene; 60880-98-0; DSSTox_CID_1284; 9044-64-8; Polystyrene standard, M.W. 5,200, Mw/Mn 1.06; STYRENE; NCGC00258362-01; Vinylbenzene; 23065-05-6; 644984-36-1; Polystyrene standard, M.W. 2,000,000, Mw/Mn 1.30; NCI-C02200; 143365-EP2287166A2; c0115; Bulstren K-525-19; 471865-10-8; Polystyrene standard, M.W. 25,000, Mw/Mn 1.06; Polystyrene latex microsphere, 1 micron, 10 wt% dispersion in water; Ethylenated benzene; 54578-24-4; 459410_ALDRICH; Polystyrene standard, M.W. 170,000, Mw/Mn 1.06; 81416_FLUKA; 00952_FLUKA; 00948_FLUKA; 8053AF; 00947_FLUKA; 327743_ALDRICH; Ethenylbenzene, 9CI; Polystyrene med Mol. Wt.; S0095; AN-24550; 5487-EP2311798A1; Styrene polymer-bound; 81401_FLUKA; 5487-EP2314577A1; 124229-31-8; CTK0H6242; Phenylethylene; Polystyrene latex microsphere, 1 micron, dry form; 459402_ALDRICH; Polystrene Standard broad 350'000; 20225_SUPELCO; Styron (Salt/Mix); Polystyrene standard, M.W. 4,000, Mw/Mn 1.06; 81409_FLUKA; 00926_FLUKA; 55128-06-8; Vinyl-polystyrene; Vinylbenzen [Czech]; 00951_FLUKA; 260975-79-9; 98444-30-5; Styrene monomer; Styrolene; 852837-17-3; ZB015538; Polystyrene latex microsphere, 0.50 micron, 2.5 wt% dispersion in water; 5487-EP2284165A1; 120037-99-2; FEMA Number 3234; Diarex hf 77; MCULE-4715354738; 5487-EP2311796A1; 182427_ALDRICH; 172867-64-0; 441147_ALDRICH; 161776-45-0; Styrene monomer, inhibited [UN2055] [Flammable liquid]; 45993_RIEDEL; 327786_ALDRICH; KS-00000VQV; 459372_ALDRICH; 327816_ALDRICH; Polystyrene latex microsphere, 75.0 micron, 2.5 wt% dispersion in water; Styreen [Dutch]; 81417_FLUKA; Polystyrene latex microsphere, 0.10 micron, 2.5 wt% dispersion in water; Styrene (monomer); Polystyrene standard, M.W. 123,000, Mw/Mn 1.08; 5487-EP2272849A1; Polystyrene standard, M.W. 900,000, Mw/Mn 1.10; 81403_FLUKA; TRA0031624; Polystyrene standard, M.W. 65,000, Mw/Mn 1.06; 5487-EP2298743A1; 155197-45-8; 63849-49-0; NCGC00091056-04; 81411_FLUKA; 81404_FLUKA; Polystyrene standard, MW ~ 1,300, MW/MN = 1.06 1g; 5487-EP2272832A1; Polystyrene standard, M.W. 3,350, Mw/Mn 1.10; 459461_ALDRICH; 360046-70-4; ZINC112958499; I01-4405; 9003-53-6; 47745U_SUPELCO; Benzene, ethylenated; Styrol (German); Diarex hf 77 (Salt/Mix); 5487-EP2295438A1; ethenyl-benzene; 117294-EP2275408A1; Polystyrene, minimum number average molecular weight (in amu), 50,000; 37291-EP2311802A1; Polystyrene standard, M.W. 400,000, Mw/Mn 1.06; 20217_SUPELCO; 5487-EP2308857A1; 40257U_SUPELCO; 12627-11-1; UNII-44LJ2U959V; ANW-14280; ZINC968269; 1160710-79-1; C07083; Styrene solution, certified reference material, 200 mug/mL in methanol; 1227265-55-5; 53397_FLUKA; 330353_ALDRICH; 171022-02-9; POLYSTYRENE; Styrol; 459399_ALDRICH; Styrole; Stirolo; Polystrene Standard 88'000; Polystrene Standard broad 206'000; HSDB 171; Chromosorb 106; 327778_ALDRICH; Styropor; RT-000109; 327751_ALDRICH; 5487-EP2292593A2; LS-304; 459380_ALDRICH; 5487-EP2270101A1; 5487-EP2311797A1; 81419_FLUKA; 44LJ2U959V; 5487-EP2314579A1; 5487-EP2298753A1; p-vinyl benzene; 327727_ALDRICH; CAS-100-42-5; A800199; 60328-46-3; AC1L1OWJ; FT-0659991; 5487-EP2311799A1; NSC62785; 81410_FLUKA; MolPort-001-779-766; EINECS 202-851-5; Polystyrene latex microsphere, 2 micron, 10 wt% dispersion in water; Polystyrene standard, M.W. 2,000, Mw/Mn 1.10; FEMA No. 3233; 459356_ALDRICH; BP-13451; 56451-72-0; 81414_FLUKA; Styrene, >=99%; 81408_FLUKA; Cinnamol; Polystyrene latex microsphere, 45.0 micron, 2.5 wt% dispersion in water; Styrene monomer, inhibited [UN2055] [Flammable liquid]; Styropol; 00954_FLUKA; Z966690906; Polystyrene standard, M.W. 50,000, Mw/Mn 1.06; Benzene-d5, ethenyl-d3-; STL283958; 137262-45-4; 331651_ALDRICH; 450383_ALDRICH; 120534-26-1; CARINE; Chromosorb 103,80/100,50G; 5487-EP2305668A1; Benzene, vinyl-; 144637-93-4; 5487-EP2308865A1; 56748-62-0; 5487-EP2295427A1; 124229-48-7; 330345_ALDRICH; MFCD00008612; WLN: 1U1R; NCGC00091056-05; 5487-EP2272935A1; 60120-16-3; 1187742-34-2; Styrene, ReagentPlus(R), 99.9%; UN2055; Polystyrene latex microsphere, 0.75 micron, 2.5 wt% dispersion in water; Chromosorb 102; Vinylbenzen; DSSTox_GSID_21284; F1908-0130; 157243-21-5; 430102_ALDRICH; Styrene; 5487-EP2295420A1; Polystyrene, hydrogenated; Styrene, ReagentPlus(R), contains 4-tert-butylcatechol as stabilizer, >=99%; Polystyrene latex microsphere, 90.0 micron, 2.5 wt% dispersion in water; Polystyrene standard, M.W. 650,000, Mw/Mn 1.06; Styrene-divinylbenzene Copolymer; SC-75569; 48347_SUPELCO |
C8H8 |
104.15 g/mol |
C=CC1=CC=CC=C1 |
|
TCMBANKIN058041 |
chavicol |
Phenol,4-(2-propen-1-yl)-; Phenol, p-allyl- (8CI); I14-56356; .gamma.-(p-Hydroxyphenyl)-.alpha.-propylene; alpha -propylene; AC1Q7A4U; 3-(p-Hydroxyphenyl)-1-propene; LS-167638; 4-Allylphenol; p-Chavicol; EINECS 207-929-2; NSC-290195; laquo gammaRaquo -(p-hydroxyphenyl)-alpha -propylene; MFCD01940501; SCHEMBL30870; W-4067; AKOS006278514; p-Allylphenol; KS-000009EP; NSC290195; AB0197728; 501A928; CCRIS 3208; MCULE-8960123940; 4-(2-propenyl)-phenol; RGIBXDHONMXTLI-UHFFFAOYSA-; 4-(Prop-2-enyl)-phenol; CHEBI:50158; CHEMBL108862; InChI=1/C9H10O/c1-2-3-8-4-6-9(10)7-5-8/h2,4-7,10H,1,3H2; CHAVICOL; Phenol, 4-(2-propenyl)-; p-Allyl-Phenol; AN-21426; p-Hydroxyallylpropene; NSC 290195; ZINC1565456; RGIBXDHONMXTLI-UHFFFAOYSA-N; Phenol, 4-(2-propenyl)- (9CI); UNII-T5721BH5Z4 component RGIBXDHONMXTLI-UHFFFAOYSA-N; KB-239888; AC1L294Y; Phenol, p-allyl-; 4-prop-2-enylphenol; 501-92-8; SC-22043; 4-(prop-2-en-1-yl)phenol; 3-(4-Hydroxyphenyl)-1-propene; UNII-Q5ER4K6969; 4-(2-Propenyl)phenol; p-Hydroxyallylbenzene; CJ-24615; BBL018739; C16930; 4-Allyl-Phenol; Q5ER4K6969; CTK4J2234; DTXSID60198210; MolPort-006-111-494; gamma-(p-Hydroxyphenyl)-alpha-propylene; Chavicol;4-allylphenol;4-(2-propenyl)- phenol |
C9H10O |
134.18 |
C=CCC1=CC=C(C=C1)O |
|
TCMBANKIN058043 |
safrole |
saf rAllyldioxybenzene methylene ether; 8022-92-2; Safrole MF; Rhyuno oil; m-Allylpyrocatechin methylene ether; Spectrum5_000843; WLN: T56 BO DO CHJ G2U1; 1,2-Methylenedioxy-4-allylbenzene; C10490; Allylpyrocatechol methylene ether; NSC 11831; Allylcatechol methylene ether; BENZENE,1-ALLYL,3,4-METHYLENEDIOXY SAFROLE; 5-19-01-00553 (Beilstein Handbook Reference); Shikomol; S9652_SIGMA; 1-Allyl-3,4-methylenedioxybenzene; BSPBio_002810; [1,2-(Methylenedioxy)-4-allyl]benzene; Spectrum_001446; Safrole; 1,3-Benzodioxole, 5-(2-propenyl)-; AI3-00514; DivK1c_001022; EINECS 202-345-4; KBio2_004494; 4-Allylpyrocatechol; 4-Allyl-1,2-methylenedioxybenzene; NSC11831; KBio3_002030; KBio2_001926; KBioSS_001926; 3,4-(Methylenedioxy)allylbenzene; 5-(2-Propenyl)-1,3-benzodioxole; Sassafras; KBioGR_002319; 1406-55-9; ST5406117; SPBio_000850; RCRA waste number U203; (Allyldioxy)benzene methylene ether; 5-prop-2-enyl-1,3-benzodioxole; Spectrum4_001939; KBio2_007062; 94-59-7; SDCCGMLS-0066708.P001; 4-Allylpyrocatechol formaldehyde acetal; NINDS_001022; BRN 0136380; 5-Allyl-1,3-benzodioxole; CCRIS 553; Caswell No. 729; InChI=1/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2,4-6H,1,3,7H; EPA Pesticide Chemical Code 097901; HSDB 2653; Shikimole; Spectrum3_001105; SPECTRUM1503620; NCGC00091122-02; Spectrum2_000775; 1-Allyl-3,4-(methylenedioxy)benzene; 4-Allyl-1,2-(methylenedioxy)benzene; NCGC00091122-03; Benzene, 4-allyl-1,2-(methylenedioxy)-; NCGC00091122-01; IDI1_001022; ZINC00002050; Benzene, 1,2-methylenedioxy-4-allyl-; Safrene; RCRA waste no. U203; 1,2-(Methylenedioxy)-4-allylbenzene; 1,3-Benzodioxole, 5-allyl-; KBio1_001022ole; Safrol |
C10H10O2 |
162.19g/mol |
C=CCC1=CC2=C(C=C1)OCO2 |
|
TCMBANKIN058081 |
Dilospan S |
1,3,5-Benzenetriol; P1178_SIGMA; ST5214381; 5-Benzenetriol; 79330_FLUKA; Floroglucinol [Czech]; CHEBI:16204; 108-73-6; c0026; 1,3,5-THB; NSC 1572; D00152; Phloroglucinol solution; Benzene-s-triol; WLN: QR CQ EQ; InChI=1/C6H6O3/c7-4-1-5(8)3-6(9)2-4/h1-3,7-9; 3,5-Dihydroxyphenol; s-Trihydroxybenzene; C02183; sym-Trihydroxybenzene; CPD-16; 1,3,5-Trihydroxycyclohexatriene; AIDS017800; AIDS-017800; Phloroglucinol (JAN); ZINC00391883; Benzene, trihydroxy; BRN 1341907; P38005_ALDRICH; Benzene, 1,3,5-trihydroxy-; 1,3,5-Triol; NCGC00166270-01; Benzene-1,3,5-triol; Phloroglucine; Spasfon-Lyoc; Floroglucin [Czech]; EINECS 203-611-2; Phloroglucinol; 34611_RIEDEL; 5-Hydroxyresorcinol; 4-06-00-07361 (Beilstein Handbook Reference); NSC1572; 5-Oxyresorcinol; P3502_SIAL; AI3-08848; Dilospan S (TN); CCRIS 4147; Phloroglucin; 1,3,5-Trihydroxybenzene; 5-Oxyresorcinolphloroglucin; phloroglucinol |
C6H6O3 |
126.11 |
C1=C(C=C(C=C1O)O)O |
|
TCMBANKIN058094 |
5-HMF |
5-(Hydroxymethyl)-2-furancarboxaldehyde; 5-18-01-00130 (Beilstein Handbook Reference); 2-Furancarboxaldehyde, 5-(hydroxymethyl)-; 2-Hydroxymethyl-5-furfural; BRN 0110889; 5-(Hydroxymethyl)-2-furancarbonal; CCRIS 3160; CBiol_000485; 67-47-0; NSC40738; SBB004259; 2-Furaldehyde, 5-(hydroxymethyl)-; 5-(Hydroxymethyl)-2-furaldehyde; 5-(hydroxymethyl)furan-2-carbaldehyde; Hydroxymethylfurfurole; 5-Hydroxymethylfurfural; 5-Hydroxymethylfuraldehyde; C11101; 5-(Hydroxymethyl)furfural; 5-Oxymethylfurfurole; InChI=1/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H; EINECS 200-654-9; W501808_ALDRICH; Hydroxymethylfurfuralaldehyde; 5-(Hydroxymethyl)-2-furfuraldehyde; ICCB3_000133; H40807_ALDRICH; Hydroxymethylfurfural; 5-Hydroxymethyl-2-furancarboxaldehyde; NCGC00091513-01; 55690_FLUKA; 5-Hydroxymethyl furaldehyde; 5-(Hyddroxymethyl)furfurole; 5-Hydroxymethyl-2-furaldehyde; 5-(Hydroxymethyl)-2-furfural; NSC 40738; 76330-16-0; Hydroxymethylfurfuraldehyde; 5-Hydroxymethyl-2-formylfuran; ZINC00900788; 5-Hydroxymethylfuran-2-aldehyde; 5-methylolfurfural; 5-hydroxymethylfuraldehyde; 5-hydroxymethyl furfural; 5-hydroxy methyl furfural; 5-hydroxymethylfurfural; 2-Furancarboxaldehyde,5-(hydroxymethyl); 5-hydroxymethyl furaldehyde; 5-hydroxymethyl-2-furfural; 5-(hydroxymethyl)-2-furfural; 5- hydroxymethylfurfural; 2-Furancarboxaldehyde , 5-(hydroxymethyl) |
C6H6O3 |
126.11 g/mol |
C1=C(OC(=C1)C=O)CO |
|
TCMBANKIN058103 |
2,6-dihydroxybenzoicacid |
GRE; NSC49172; 4-10-00-01456 (Beilstein Handbook Reference); .gamma.-Resorcylic acid; 2,6-Dihydroxybenzoic acid; 303-07-1; D109606_ALDRICH; Benzoic acid, 2,6-dihydroxy-; BB_SC-2393; BRN 2209755; gamma-Resorcylic acid (8CI); 2,6-Resorcylic acid; gamma-Resorcylic acid; InChI=1/C7H6O4/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,8-9H,(H,10,11; EINECS 206-134-8; 2-Carboxyresorcinol; BENZOIC ACID,2,6-DIHYDROXY MFC7 H6 O4; NSC 49172; 6-Hydroxysalicylic acid |
C7H6O4 |
154.12 g/mol |
C1=CC(=C(C(=C1)O)C(=O)O)O |
|
TCMBANKIN058114 |
trans-caffeic acid |
3-(3,4-dihydroxy-phenyl)-acrylic acid; caffeic acid; Caffeate; Lopac-C-0625; 71693-97-5; DivK1c_006624; KBio2_007302; (Z)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid; NCGC00015206-02; CAS-3331-39-5; 60020_FLUKA; AI3-63211; 3-(3,4-Dihydroxyphenyl)-2-propenoic acid polymer; (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid; NSC623438; 4-(2'-Carboxyvinyl)-1,2-dihydroxybenzene; KBio2_004734; (2Z)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid; CHEMBL1320034; AIDS-002287; AIDS002287; 501-16-6; CHEBI:36281; Prestwick1_000902; KBio1_001568; 3-(3,4-Dihydroxyphenyl)-2-propenoic acid; AKOS000273846; OR1165; SMR000058214; Spectrum2_001612; 3,4-dihydroxycinnamate; (Z)-3-(3,4-dihydroxyphenyl)acrylic acid; Caffeicacid; KOP; AC1NO658; CCRIS 847; Caffeic acid dehydrogenation homopolymer; SPECTRUM1503987; Spectrum4_001694; SCHEMBL3682144; NCGC00017364-01; NCGC00022654-08; 4-(2-Carboxyethenyl)-1,2-dihydroxybenzene; 78734C5A-1281-44D4-B8A0-A3188AD437E3; cis-Caffeic acid; 3-(3,4-dihydroxyphenyl)acrylic acid; Cinnamic acid, 3,4-dihydroxy-; KBioGR_001988; 3,4-Dihydroxybenzeneacrylic acid; 3,4-dihydroxycinnamic acid; trans-caffeic acid; AIDS-026339; NCGC00015206-01; HSDB 7088; ZINC4482687; (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid; 3-(3,4-dihydroxyphenyl)prop-2-enoate; Isocaffeic acid; SBB006475; InChI=1/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2; NCGC00017364-02; EU-0100208; C01197; MolPort-001-759-162; KBioSS_002166; Caffeic acid pure; caffeic acid ; trans-Caffeate; (2E)-3-(3,4-dihydroxyphenyl)acrylic acid; NSC 57197; (2E)-3-(3,4-Dihydroxyphenyl)-2-propenoic acid; Spectrum_001686; 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, (E)-; KBio2_002166; Caffeic acid, cis-; 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-; 3,4-Dihydroxybenzeneacrylate; 3-(3,4-Dihydroxy phenyl)-2-propenoic acid; 4361-87-9; 3,4-Dihydroxy-trans-cinnamate; caffeicacid; AR-360/40806927; EINECS 206-361-2; 60018_FLUKA; Caffeic acid polymer; (E)-3-(3,4-dihydroxyphenyl)acrylic acid; NCGC00022654-04; ZX-AL002121; C0625_SIGMA; SDCCGMLS-0002982.P003; 3-(3,4-Dihydroxyphenyl)-2-propenoic acid, homopolymer; SPBio_001643; 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)- (9CI); NCGC00017364-03; 3-(3,4-dihydroxyphenyl)prop-2-enoic acid; AC1LU7RL; SPBio_002943; CHEBI:16433; AIDS026339; 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, homopolymer; CHEBI:17395; TNP00311; SpecPlus_000528; Prestwick0_000902; MLS000069738; 3,4-dihydroxy-cinnamic acid; 3-(3,4-Dihydroxyphenyl)propenoic acid; NCI60_004400; NSC57197; Caffeic; Lopac-C-0625; NCGC00015206-01; Caffeic acid; cis-Caffeic acid; NCGC00017364-01; (Z)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid; C01481; 331-39-5; NCGC00015206-02; CAS-3331-39-5; 3,4-Dihydroxycinnamic acid; CHEBI:17395; (2Z)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid; TNP00311; (Z)-3-(3,4-dihydroxyphenyl)acrylic acid; Caffeate; 1- coffee acid |
C9H8O4 |
180.16 g/mol |
C1=CC(=C(C=C1C=CC(=O)O)O)O |
|
TCMBANKIN058124 |
protocatechualdehyde |
UNII-4PVP2HCH4T; CP0106; RP20407; AIDS108195; ACMC-1BU4F; AB1003652; 4-Formyl-1,2-dihydroxybenzene; PS-5533; 39D855; KSC174Q9D; AKOS000119507; F2190-0614; KB-28320; 3,4-Dihydroxybenzaldehyde, homopolymer; MCULE-8201140117; D0566; ACMC-20mvlo; 3,4-Dihydroxybenzaldehyde, 97%; 3,4 dihydroxybenzaldehyde; I01-0489; AZ0001-0159; MFCD00003370; MolPort-000-672-422; 37520_FLUKA; AC1Q78G5; MLS001148401; 2-HYDROXY-4-(HYDROXYMETHYLIDENE)CYCLOHEXA-2,5-DIEN-1-ONE; AC1Q6Q41; TR-032901; AJ-08356; ST5202222; 1,2-Dihydroxy-4-formylbenzene; 3,4-dihydroxybenzaldehyde; LS-125886; BB_NC-2317; 3, 4-Dihydroxybenzaldehyde; Opera_ID_356; 3,4-dihydroxy benzaldehyde; 4-Formylcatechol; CTK0B9895; Protocatechuic aldehyde; ANW-20526; 4-Formylbenzene-1,2-diol; 3,4-Dihydroxybenzaldehyde, Vetec(TM) reagent grade, 97%; M-6274; CJ-00132; ACon1_001620; 3,4-Dihydroxybenzyl aldehyde; ST50202222; STL146017; D108405_ALDRICH; Benzaldehyde, 3,4-dihydroxy-; A15221; 419370_ALDRICH; catechaldehyde; AC1L1RNP; Benzaldehyde, 3,4-dihydroxy- (9CI); NCGC00180319-01; AB0008392; protocatechuic aldehyde; ST2417247; MEGxm0_000158; BP-11465; PROTOCATECHUIC ALDEHYDE; BR-39223; AIDS-108195; Protocatechualdehyde; 4PVP2HCH4T; 4CN-0731; AR-360/40191185; EINECS 205-377-7; AIDS-022744; Rancinamycin IV; 3,4-DHBAOP; CHEMBL222021; 3,4-Dihydroxybenzaldehyde, purum, >=97.0% (HPLC); ZINC13245; protocatec-hualdehyde; ACN-S002767; SMR000059038; SC-01003; Nc 033; 4,5-Dihydroxybenzaldehyde; ZINC00013245; BBL010377; IBGBGRVKPALMCQ-UHFFFAOYSA-N; PubChem8231; NSC22961; SCHEMBL36350; 3,4-Dihydroxybenzaldehyde, analytical standard; SBB040269; AIDS022744; DB11268; FT-0614322; 139-85-5; N2276; InChI=1/C7H6O3/c8-4-5-1-2-6(9)7(10)3-5/h1-4,9-10; HMS2236H03; LS10200; 134998-43-9; 3,4-dihydroxy-benzaldehyde; D-3480; KS-000002OG; 2,5-Cyclohexadien-1-one, 2-hydroxy-4-(hydroxymethylene)-; CM13991; 4-Formyl-1,2-benzenediol; 3,4-Dihydroxybenzaldehyde; AN-43839; 3,4-Dihydroxybenzenecarbonal; BG01497764; EBD970769; TRA0091487; RTR-032901; 4-(Hydroxymethylene)-2-hydroxy-2,5-cyclohexadien-1-one; NSC-22961; DTXSID4074512; CHEBI:50205; AC-10830; MLS000069606; AM20020464; CS-W009195; CTK0H4891; AK-39223; NSC 22961; HMS3370F03; ZB000709 |
C7H6O3 |
138.12 |
C1=CC(=C(C=C1C=O)O)O |
|
TCMBANKIN058163 |
hydroxytyrosol |
AIDS470832; 10597-60-1; beta-3,4-Dihydroxyphenylethyl alcohol; 4-(2-hydroxyethyl)pyrocatechol; 1,2-Benzenediol, 4-(2-hydroxyethyl)-; 3,4-Dihydroxyphenylethanol; 2-(3,4-Dihydroxyphenyl)ethanol; dopet; AIDS-470832; 4-(2-hydroxyethyl)benzene-1,2-diol; Hydroxytyrosol; ST5437419; 3,4-dihydroxyphenethyl alcohol; 3,4-dihydroxyphenylethanol |
C8H10O3 |
154.16 g/mol |
C1=CC(=C(C=C1CCO)O)O |
|
TCMBANKIN058171 |
GENOP |
BRN 2209119; NCIOpen2_000913; BSPBio_003051; Gentisinic acid polymer; BENZOIC ACID,2,5-DIHYDROXY; AIDS-002955; Salicylic acid, 5-hydroxy-; Spectrum4_001821; 4955-90-2 (SODIUM SALT); KBio1_000538; C00628; KBio2_001721; 5-Hydroxysalicylic acid; Resorcyllic acid, alphaodium 2,5-dihydroxybenzoate; SPBio_000846; KBioSS_001721; Spectrum2_000773; Kyselina gentisinova [Czech]; 39319_FLUKA; 2,5-Dioxybenzoic acid; 2,5-Dhba; Gensigen; 490-79-9; KBioGR_002487; KBio3_002271; 4-10-00-01441 (Beilstein Handbook Reference); Spectrum3_001326; Benzoic acid, 2,5-dihydroxy-; Acidum gentisicum [INN-Latin]; Gentisate; Acido gentisico [INN-Spanish]; Spectrum5_000581; Gentisinic acid; Spectrum_001241; 2,5-Dihydroxybenzoic acid; Kyselina 2,5-dihydroxybenzoova [Czech]; IVK/9045696; NSC27224; KBio2_004289; Acide gentisique [INN-French]; Gentisic acid; DivK1c_000538; NSC8512 (SODIUM SALT); AIDS027706; NSC 27224; AIDS-027706; Gensigon; EINECS 207-718-5; Hydroquinonecarboxylic acid; CHEBI:17189; AI3-60431; WLN: QVR BQ EQ; 149357_ALDRICH; IDI1_000538; AIDS002955; Acido 2,5-diidrossibenzoico [Italian]; Oprea1_039290; NINDS_000538; InChI=1/C7H6O4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,8-9H,(H,10,11; KBio2_006857; NSC49098; 2,5-dihydroxy benzoic acid; 2,5-dihydroxybenzoic acid; 2,5-dihydroxy-benzoic acid; gentisicacid; 2, 5-dihydroxybenzoic acid; gentisic acid |
C7H6O4 |
154.12g/mol |
C1=CC(=C(C=C1O)C(=O)O)O |
|
TCMBANKIN058173 |
DOB |
beta-Resorcylic acid; RESORCYLIC ACID, BETA; Benzoic acid, 2,4-dihydroxy-; STK299216; NSC4740; NSC 13564; 4-Carboxyresorcinol; D109401_ALDRICH; 4-Hydroxysalicylic acid; .beta.-Resorcinolic acid; 2,4-Dihydroxybenzoic acid; NSC13564; AIDS-018062; W379808_ALDRICH; 4-10-00-01420 (Beilstein Handbook Reference); InChI=1/C7H6O4/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,8-9H,(H,10,11; .beta.-Resorcylic acid; 89-86-1; BRA; AI3-24366; beta-Resorcinolic acid; 37530_FLUKA; 2,4-Dhba; EINECS 201-946-9; BRN 1946213; AIDS018062; Oprea1_259729; NCGC00090922-02; p-Hydroxysalicylic acid; NCGC00090922-01;β-resorcylicacid |
C7H6O4 |
154.12 g/mol |
C1=CC(=C(C=C1O)O)C(=O)O |
|
TCMBANKIN058182 |
m-hydroxybenzaldehyde |
m-Formylphenol;3-hydroxybenzaldehyde;NSC 3504; CHEBI:16207; meta-Hydroxybenzaldehyde; 3-OH-BENZALDEHYDE; NSC3504; 3-HYDROXY-BENZALDEHYDE; ZINC00901630; Benzaldehyde, m-hydroxy-; BRN 0507099; 3-hydroxybenzaldehyde; Benzaldehyde, 3-hydroxy-; H19808_ALDRICH; ST5213351; 100-83-4; 4-08-00-00240 (Beilstein Handbook Reference); InChI=1/C7H6O2/c8-5-6-2-1-3-7(9)4-6/h1-5,9; EINECS 202-892-9; C03067; 3-Formylphenol; c0055; AI3-12120; m-Hydroxybenzaldehyde |
C7H6O2 |
122.12 g/mol |
C1=CC(=CC(=C1)O)C=O |
|
TCMBANKIN058183 |
meta-aminophenol |
Nako TEG; 3-Hydroxyaniline; WLN: ZR CQ; CI 76545; CI Oxidation Base 7; Fouramine EG; m-Aminofenol [Czech]; 09130_FLUKA; 1-Amino-3-hydroxybenzene; 3-Aminophenol; Tertral EG; 100242_ALDRICH; NCGC00091247-01; AIDS019901; Furro EG; m-Aminofenol; AI3-14871; AIDS-019901; ZINC00157527; CCRIS 4145; m-Aminophenol; 36684_RIEDEL; m-Hydroxyaminobenzene; EINECS 209-711-2; InChI=1/C6H7NO/c7-5-2-1-3-6(8)4-5/h1-4,8H,7H; Pelagol EG; Fourrine EG; m-Hydroxyaniline; NSC1546; 3-Amino-1-hydroxybenzene; Futramine EG; Phenol, m-amino-; NSC 1546; Phenol, 3-amino-; C.I. 76545; Basf ursol eg; Fourrine 65; STK258727; Renal EG; m-Hydroxyphenylamine; 591-27-5; m-Aminophenol [UN2512] [Poison]; CHEBI:28924; HSDB 2586; PHENOL,3-AMINO; C.I. Oxidation Base 7; Ursol EG; C05058;NSC-1546; CI 76545; TL8003775; 75925-EP2308880A1; DSSTox_CID_4497; CJ-01679; TR-032614; AI3-14871; 3-Aminophenol, 98%; BB_SC-7384; CCRIS 4145; SMR001370906; I01-4370; ACMC-1B14M; RP18926; AK109174; AS00213; SBB059791; CHEMBL269755; m-Aminophenol, United States Pharmacopeia (USP) Reference Standard; MolPort-001-790-594; 3-hydroxy-aniline; Fourrine EG; 3-Aminophenol, puriss., 99%; m-Hydroxyaniline; AC1Q51QS; PubChem18119; ST2410473; AMINOPHENOL-3; Fourrine 65; m-Hydroxyphenylamine; BASF ursol EG; CHEBI:28924; CWLKGDAVCFYWJK-UHFFFAOYSA-N; BIDD:GT0645; ZINC157527; C.I. Oxidation Base 7; Ursol EG; PS-9279; 3-Hydroxyaniline; WLN: ZR CQ; 3-hydroxybenzenamine; Fouramine EG; ANW-33166; AJ-15049; 1-Amino-3-hydroxybenzene; 3-Aminophenol; Tertral EG; NCGC00258260-01; LABOTEST-BB LTBB000485; BP-13467; 75925-EP2281563A1; TRA0033231; 3-Aminophenol, PESTANAL(R), analytical standard; META AMINO PHENOL; AKOS000118984; MLS002415740; 3-Aminophenol, purum, >=98.0% (T); A0383; 3-amino phenol; UNII-L3WTS6QT82; BIDD:ER0564; AN-21535; DSSTox_GSID_24497; 3-Amino-1-hydroxybenzene; Futramine EG; Phenol, m-amino-; NSC 1546; LS-256; F3228-0191; DTXSID3024497; BBL011987; amino-3-hydroxybenzene; 3-Aminophenol, Pharmaceutical Secondary Standard; Certified Reference Material; DSSTox_RID_77427; m-Aminophenol [UN2512] [Poison]; 75925-EP2305808A1; HSDB 2586; PHENOL,3-AMINO; NCGC00091247-02; BG00599912; BDBM50428384; J-511713; CI Oxidation Base 7; m-Aminophenol [UN2512] [Poison]; m-Aminofenol [Czech]; ST45255313; UNII-LST7140D72 component CWLKGDAVCFYWJK-UHFFFAOYSA-N; FT-0615052; CAS-591-27-5; Furro EG; 38171-54-9 (mono-hydrochloride salt); DB-024153; KB-86271; meta-aminophenol; Pelagol EG; m-Amino phenol; AC1L1XMR; m-amino-phenol; NSC1546; Phenol, 3-amino-; ACT07279; STK258727; NE10511; AC1Q7AKB; SCHEMBL35586; C05058; Nako TEG; 3-amino-phenol; L3WTS6QT82; EC 209-711-2; NCGC00091247-01; STR01006; m-Aminofenol; Zoba EG; SC-18440; MFCD00007786; VU0606052-1; m-Hydroxyaminobenzene; EINECS 209-711-2; InChI=1/C6H7NO/c7-5-2-1-3-6(8)4-5/h1-4,8H,7H; M-AMINOPHENOL; ZB006713; KS-00000VZ4; HMS3039L12; 68239-81-6 (sulfate); Z319217206; C.I. 76545; Renal EG; 591-27-5; UN 2512 (Salt/Mix); 5-AMINO-PHENOL; Tox21_200706; 51-81-0 (hydrochloride); MCULE-7576733778 |
C6H7NO |
109.13 g/mol |
C1=CC(=CC(=C1)O)N |
|
TCMBANKIN058188 |
PHB |
NSC4961; AE-848/32195059; AIDS-018038; AI3-01003; 4-Hydroxybenzoic acid; Benzoic acid, p-hydroxy-; ST5210584; 54630_FLUKA; C00156; 4-HBA; InChI=1/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10; Acido p-idrossibenzoico [Italian]; HSDB 7233; 99-96-7; p-Salicylic acid; p-Oxybenzoesaure [German]; HYDROXYBENZOIC ACID, PARA; NSC 4961; Benzoic acid, p-hydroxy; EINECS 202-804-9; CHEBI:30763; p-Hydroxybenzoic acid; H20059_ALDRICH; 240141_ALDRICH; NCGC00166040-01; Kyselina 4-hydroxybenzoova [Czech]; 4-Carboxyphenol; Benzoic acid, 4-hydroxy; W398608_ALDRICH; 4-Hydroxybenzoesaeure; Benzoic acid, 4-hydroxy-; AIDS018038; WLN: QVR DQ; 4-hydroxybenzoic; 4-hydroxy benzoic acid |
C7H6O3 |
138.12 g/mol |
C1=CC(=CC=C1C(=O)O)O |
|
TCMBANKIN058211 |
p-aminobenzaldehyde |
WLN: ZR DVH;Benzaldehyde, 4-amino-; BRN 1362885; 4-14-00-00048 (Beilstein Handbook Reference); ZINC01677280; 4-Aminobenzaldehyde; NSC60117; Benzaldehyde, p-amino- (8CI); p-Formylaniline; p-Aminobenzaldehyde; InChI=1/C7H7NO/c8-7-3-1-6(5-9)2-4-7/h1-5H,8H; 4-Formylaniline; NSC45163; Benzaldehyde, p-amino-; Benzaldehyde, 4-amino-, homopolymer; 556-18-3; 28107-09-7; NSC 45163; EINECS 209-115-2 |
C7H7NO |
121.14 g/mol |
C1=CC(=CC=C1C=O)N |
|
TCMBANKIN058212 |
4-hydroxybenzaldehyde;HBA |
4-hydroxybenzal-dehyde; 4-hydroxy-benzaldehyde;54590_FLUKA; p-Oxybenzaldehyde; ST5213381; 123-08-0; p-Hydroxybenzaldehyde; FR-0985; 65581-83-1; AIDS-017917; InChI=1/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9; 4-HYDROXY-BENZALDEHYDE; ZINC00156709; BRN 0471352; Benzaldehyde, 4-hydroxy-, homopolymer; 4-08-00-00251 (Beilstein Handbook Reference); CHEBI:17597; NSC 2127; 4-Formylphenol; Benzaldehyde, p-hydroxy-; Usaf m-6; AIDS017917; 4-HYDROXYBENZALDEHYDE; 54589_FLUKA; AI3-15366; Benzaldehyde, 4-hydroxy-; Parahydroxybenzaldehyde; C00633; AB-131/40191192; p-Formylphenol; c0285; NSC2127; WLN: VHR DQ; W398403_ALDRICH; 4-Hydroxybenzaldehyde, homopolymer; EINECS 204-599-1; 144088_ALDRICH |
C7H6O2 |
122.12 |
C1=CC(=CC=C1C=O)O |
|
TCMBANKIN058252 |
tyramine |
AIDS018687; 4-(2-aminoethyl)phenol; p-.beta.-Aminoethylphenol; NINDS_000918; Spectrum2_000738; Spectrum3_000693; Phenol, p-(2-aminoethyl)-; HSDB 2132; tyraminium cation; to_000085; 2-(4-hydroxyphenyl)ethylammonium; Tenosin-Wirkstoff; tyraminium(1+); Spectrum5_000501; Lopac-T-2879; 4-Hydroxyphenethylamine; NSC249188; InChI=1/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H; BSPBio_002445; SMR000059295; Oprea1_294339; SGCUT00017; AC1NRWHX; KBio2_004261; Uteramine; BB_NC-1362; 2-(4-hydroxyphenyl)ethylazanium; 2-(4-Hydroxyphenyl)ethylamine; SPBio_000696; 3bra; Phenethylamine, p-hydroxy-; Spectrum4_001801; NCGC00063825-05; BRN 1099914; 4-Hydroxy-.beta.-phenylethylamine; 4-Hydroxyphenethylamine ((tyramine); 2-(p-Hydroxyphenyl)ethylamine; 93810_FLUKA; KBio1_000918; 51-67-2 (FREE BASE); NSC 249188; NCGC00063825-04; p-Hydroxy-.beta.-phenethylamine; NCGC00016011-01; 59880-97-6 (HCL); BPBio1_001394; ZB000512; 4-(2-Aminoethyl)phenol; KBioSS_001693; p-Hydroxyphenylethylamine; DivK1c_000918; p-Hydroxyphenethylamine; p-beta-Aminoethylphenol; NCGC00063825-07; .alpha.-(4-Hydroxyphenyl)-.beta.-aminoethane; IDI1_000918; Benzeneethanamine, 4-hydroxy-; tyraminium; WLN: Z2R DQ; beta-Hydroxyphenylethylamine; A828724; alpha-(4-Hydroxyphenyl)-beta-aminoethane; KBio2_001693; KBio3_001665; p-Tyramine; 4-Hydroxyphenylethylamine; T90344_ALDRICH; Tocosine; KBio2_006829; MLS000079096; Phenol, 4-(2-aminoethyl)-; EINECS 200-115-8; BDBM50067723; 2-(4-hydroxyphenyl)ethanaminium; Tyrosamine; .beta.-(4-Hydroxyphenyl)ethylamine; C00483; Biomol-NT_000075; Tyramine; Systogene; 4-13-00-01788 (Beilstein Handbook Reference); p-(2-Aminoethyl)phenol; 51-67-2; 2-(4-Hydroxy-phenyl)-ethyl-ammonium; Spectrum_001213; Lopac0_001136; NCGC00063825-08; CJ-00085; CHEBI:15760; CHEBI:327995; KBioGR_002405; SPECTRUM210400; LS-189905; (4-hydroxyphenethyl)ammonium; AIDS-018687; Tyramin; 4-Hydroxyphenethylaminium |
C8H11NO |
137.18 |
C1=CC(=CC=C1CCN)O |
|
TCMBANKIN058255 |
Tyrosol |
NSC 59876; 4-Hydroxybenzeneethanol; P-HYDROXYPHENETHYL ALCOHOL; NSC59876; tyrosol; 56105_FLUKA; Benzeneethanol, 4-hydroxy-; 2-(4-Hydroxyphenyl)ethanol; 4-Hydroxyphenethyl alcohol; 2-(P-HYDROXYPHENYL)ETHANOL; ZINC00164581; SB 01196; 4-(2-hydroxyethyl)phenol; InChI=1/C8H10O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,9-10H,5-6H; EINECS 207-930-8; 4-Hydroxyphenylethanol; CHEBI:1879; 501-94-0; 188255_ALDRICH; 79058_FLUKA; C06044; 2-(4-hydroxyphenyl)-ethanol; 4-hydroxyphenethyl alcohol; p-hydroxyphenylethanol; p-hydroxyphenethyl alcohol; 2-(4-hydroxyphenyl)ethanol; p-hydroxyphenylethyl alcohol |
C8H10O2 |
138.16 g/mol |
C1=CC(=CC=C1CCO)O |
|
TCMBANKIN058259 |
p-aminophenol;para-aminophenol |
4-AMINO-PHENOL; Tox21_113477; SBB059792; para aminophenol; Fourrine 84; AS04549; 9225-EP2275420A1; DSSTox_GSID_24499; 4-Aminophenol (Acetaminophen Related Compound K) (Paracetamol Impurity K), Pharmaceutical Secondary Standard; Certified Reference Material; Certinal; AKOS000119829; p-Aminofenol; 4-Aminophenol, >=99% (HPLC); AN-24398; CJ-12175; BDBM26195; ST088538; J-004908; FT-0617593; A0384; Benzofur P; Aminophenol, p-; NSC-1545; BB_SC-6973; AKOS016371265; AK-46590; KB-189354; CCRIS 4146; to_000006; BASF Ursol P Base; DSSTox_CID_4499; Tox21_201030; 4NL; ACMC-209aoj; SCHEMBL3424; Para-aminophenol; 4-amino phenol; p-aminobenzenol; Tertral P Base; CI 76550; Acetaminophen Impurity K; BG00599911; 4-aminophenol; 9225-EP2280008A2; p-Aminophenol [UN2512] [Poison]; bmse000462; Phenol, p-amino-; para-hydroxyaniline; AC1Q523U; 4-aminophenol?; Pelagol CP (Salt/Mix); 1-Amino-4-hydroxybenzene; AB1009438; TRA0083709; para-amino-phenol; Phenol, 4-amino-; NCGC00090816-05; 9225-EP2308872A1; Epitope ID:117708; Pelagol Grey CP (Salt/Mix); Ursol P; UNII-R7P8FRP05V; AM86423; NCGC00090816-02; Pelagol Grey P Base; CAS-123-30-8; SGCUT00256; Tox21_113477_1; HSDB 2640; R7P8FRP05V; AJ-333/25022099; Nako Brown R; p-Aminophenol [UN2512] [Poison]; Zoba Brown P Base; AI3-14872; 9225-EP2316829A1; Kodelon; 63084-98-0 (sulfate [2:1]); ST2405553; TR-003672; Takatol; ANW-18113; Rodinal; F2190-0438; NCGC00090816-01; Tox21_113242; J-514454; BBL011574; NCGC00090816-03; 4-hydroxy-aniline; C.I. 76550; 135807-EP2371803A1; PubChem22199; MFCD00007869; 4-Aminophenol, PESTANAL(R), analytical standard; 4-aminobenzenol; phenol derivative, 9; C.I. Oxidation Base 6A; C.I. Oxidation Base 6; PLIKAWJENQZMHA-UHFFFAOYSA-N; Durafur Brown R (Salt/Mix); paraaminophenol; 51-78-5 (hydrochloride); Pelagol P Base; Energol; 4-hydroxyphenylamine; SC-19013; 4-Aminophenol, >=98%; Furro P (Salt/Mix); Fouramine P; p-amino-phenol; Futramine P (Salt/Mix); Paramidophenol; 4-Aminophenol, technical grade, 95%; UN 2512; AC1Q523T; KB-79942; p-hydroxyaniline; AN-22912; Phenol,4-amino-; NSC1545; 4-hydroxyaniline; RP18925; 123-30-8; p-Aminofenol [Czech]; Z57127517; 4-Aminophenol, 250 mug/mL in acetonitrile, certified reference material, ampule of 1 mL; CHEMBL1142; L-1224; AJ-51764; MLS001066356; Durafur Brown RB; I01-0483; NCGC00258583-01; Fourrine P Base; CS-0006652; LS-676; STK286017; 135807-EP2377843A1; MCULE-3319647085; Para Amino Phenol; I924; KS-000000HN; WLN: ZR DQ; Citol; InChI=1/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H; NSC 1545; Ursol P Base; MolPort-001-641-054; Furro P Base; ZINC4623758; 4-Amino-1-hydroxybenzene; AC1L195P; Azol; p-Hydroxyphenylamine; Renal AC; UNAL; DTXSID3024499; C02372; KSC354Q5H; 4-Aminophenol, United States Pharmacopeia (USP) Reference Standard; SMR000471841; Peltol P (Salt/Mix); NCGC00090816-04; 52985-09-8; DSSTox_RID_77429; BC227837; Paranol; D07MTM; UNII-LST7140D72 component PLIKAWJENQZMHA-UHFFFAOYSA-N; EINECS 204-616-2; Mesalazine impurity A, European Pharmacopoeia (EP) Reference Standard; EC 204-616-2; CHEBI:17602;4-aminophenol; 4-AMINO-PHENOL; ZINC04623758; 35837_RIEDEL; Durafur Brown RB; Phenol, p-amino-; C.I. 76550; Fourrine P Base; AIDS019902; STK286017; A71328_ALDRICH; 1-Amino-4-hydroxybenzene; CPD-259; Fourrine 84; 4-aminobenzenol; WLN: ZR DQ; c0090; InChI=1/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H; C.I. Oxidation Base 6; p-aminophenol; Citol; NSC 1545; Ursol P Base; Certinal; Pelagol P Base; Furro P Base; Phenol, 4-amino-; p-Aminofenol; Fouramine P; Ursol P; 4-Amino-1-hydroxybenzene; Pelagol Grey P Base; CI 76550; p-Hydroxyphenylamine; Azol; Benzofur P; SGCUT00256; Aminophenol, p-; Renal AC; HSDB 2640; AJ-333/25022099; C02372; CCRIS 4146; to_000006; p-hydroxyaniline; p-Aminophenol [UN2512] [Poison]; SMR000471841; BASF Ursol P Base; Nako Brown R; NSC1545; 60034_RIEDEL; 4-hydroxyaniline; Zoba Brown P Base; 123-30-8; 4NL; p-Aminofenol [Czech]; AI3-14872; 52985-09-8; AIDS-019902; Paranol; p-aminobenzenol; Tertral P Base; EINECS 204-616-2; Rodinal; CHEBI:17602; MLS001066356; 51-78-5 (HCL); NCGC00090816-01;4-AMINO-PHENOL; Tox21_113477; SBB059792; para aminophenol; Fourrine 84; AS04549; 9225-EP2275420A1; DSSTox_GSID_24499; p-aminophenol; 4-Aminophenol (Acetaminophen Related Compound K) (Paracetamol Impurity K), Pharmaceutical Secondary Standard; Certified Reference Material; Certinal; AKOS000119829; p-Aminofenol; 4-Aminophenol, >=99% (HPLC); AN-24398; CJ-12175; BDBM26195; ST088538; J-004908; FT-0617593; A0384; Benzofur P; Aminophenol, p-; NSC-1545; BB_SC-6973; AKOS016371265; AK-46590; KB-189354; CCRIS 4146; to_000006; BASF Ursol P Base; DSSTox_CID_4499; Tox21_201030; 4NL; ACMC-209aoj; SCHEMBL3424; Para-aminophenol; 4-amino phenol; p-aminobenzenol; Tertral P Base; CI 76550; Acetaminophen Impurity K; BG00599911; 4-aminophenol; 9225-EP2280008A2; p-Aminophenol [UN2512] [Poison]; bmse000462; Phenol, p-amino-; para-hydroxyaniline; AC1Q523U; 4-aminophenol?; Pelagol CP (Salt/Mix); 1-Amino-4-hydroxybenzene; AB1009438; TRA0083709; para-amino-phenol; Phenol, 4-amino-; NCGC00090816-05; 9225-EP2308872A1; Epitope ID:117708; Pelagol Grey CP (Salt/Mix); Ursol P; UNII-R7P8FRP05V; AM86423; NCGC00090816-02; Pelagol Grey P Base; CAS-123-30-8; SGCUT00256; Tox21_113477_1; HSDB 2640; R7P8FRP05V; AJ-333/25022099; Nako Brown R; p-Aminophenol [UN2512] [Poison]; Zoba Brown P Base; AI3-14872; 9225-EP2316829A1; Kodelon; 63084-98-0 (sulfate [2:1]); ST2405553; TR-003672; Takatol; ANW-18113; Rodinal; F2190-0438; NCGC00090816-01; Tox21_113242; J-514454; BBL011574; NCGC00090816-03; 4-hydroxy-aniline; C.I. 76550; 135807-EP2371803A1; PubChem22199; MFCD00007869; 4-Aminophenol, PESTANAL(R), analytical standard; 4-aminobenzenol; phenol derivative, 9; C.I. Oxidation Base 6A; C.I. Oxidation Base 6; PLIKAWJENQZMHA-UHFFFAOYSA-N; Durafur Brown R (Salt/Mix); paraaminophenol; 51-78-5 (hydrochloride); Pelagol P Base; Energol; 4-hydroxyphenylamine; SC-19013; 4-Aminophenol, >=98%; Furro P (Salt/Mix); Fouramine P; p-amino-phenol; Futramine P (Salt/Mix); Paramidophenol; 4-Aminophenol, technical grade, 95%; UN 2512; AC1Q523T; KB-79942; p-hydroxyaniline; AN-22912; Phenol,4-amino-; NSC1545; 4-hydroxyaniline; RP18925; 123-30-8; p-Aminofenol [Czech]; Z57127517; 4-Aminophenol, 250 mug/mL in acetonitrile, certified reference material, ampule of 1 mL; CHEMBL1142; L-1224; AJ-51764; MLS001066356; Durafur Brown RB; I01-0483; NCGC00258583-01; Fourrine P Base; CS-0006652; LS-676; STK286017; 135807-EP2377843A1; MCULE-3319647085; Para Amino Phenol; I924; KS-000000HN; WLN: ZR DQ; Citol; InChI=1/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H; NSC 1545; Ursol P Base; MolPort-001-641-054; Furro P Base; ZINC4623758; 4-Amino-1-hydroxybenzene; AC1L195P; Azol; p-Hydroxyphenylamine; Renal AC; UNAL; DTXSID3024499; C02372; KSC354Q5H; 4-Aminophenol, United States Pharmacopeia (USP) Reference Standard; SMR000471841; Peltol P (Salt/Mix); NCGC00090816-04; 52985-09-8; DSSTox_RID_77429; BC227837; Paranol; D07MTM; UNII-LST7140D72 component PLIKAWJENQZMHA-UHFFFAOYSA-N; EINECS 204-616-2; Mesalazine impurity A, European Pharmacopoeia (EP) Reference Standard; EC 204-616-2; CHEBI:17602;p-aminophenol;para-aminophenol |
C6H7NO |
109.13 g/mol |
C1=CC(=CC=C1N)O |
|
TCMBANKIN058261 |
P-hydroxy phenol;hydroquinone |
KBioSS_002237; p Benzendiol; CHEBI:17594; Hydroquinone 4%, tretinoin 0.05%, fluocinolone acetonide 0.01%; C15603; Derma-Blanch; para-Dioxybenzene; Eldoquin (TN); hydroquinol; p-Dioxobenzene; EU-0100577; AIDS-000964; Dihydroxybenzene; p-Hydroquinone; HSDB 577; para-Dihydroxybenzene; 1,4-Dihydroxybenzene; EINECS 204-617-8; Hydroquinone (USP); ST5214344; Benzohydroquinone; 1,4-Dihydroxy-benzol; Phiaquin; Solaquin Forte; Hydroquinone polymer; NCGC00090880-01; Fluocinolone acetonide mixture with hydroquinone and tretinoin; D00073; AIDS-220864; 1,4-benzenediol; Melanex; Diak 5; H17902_SIAL; Eldoquin; Fluocinolone acetonide, hydroquinone, and tretinoin; 1,4-Diidrobenzene [Italian]; Spectrum2_001672; Idrochinone [Italian]; c0091; H9003_SIGMA; Dihydroquinone; InChI=1/C6H6O2/c7-5-1-2-6(8)4-3-5/h1-4,7-8; KBio2_004805; NCI-C55834; Eldopaque Forte; KBio2_002237; 8027-02-9; Hydroquinone tablets; Quinol; UN2662; CCRIS 714; 940291-89-4; p-Benzenediol; NSC 9247; HE 5; Eldoquin Forte; Spectrum4_000633; BSPBio_002291; NCGC00090880-04; para-Hydroquinone; Lopac0_000577; KBioGR_001246; 123-31-9; AIDS220864; Arctuvin; Spectrum5_001430; .beta.-Quinol; Idrochinone; Hydroquinone [UN2662] [Poison]; C00530; WLN: QR DQ; ZINC00001541; .alpha.-Hydroquinone; Spectrum_001757; p-Hydroxyphenol; 1,4-Dihydroxy-benzeen; Hydroquinone/tretinoin/fluocinolone cream; SPECTRUM1504237; Benzene-1,4-diol; MLS000069815; Triluma; p-Dioxybenzene; p-Dihydroxybenzene; 1,4-Dihydroxybenzen; SpecPlus_000769; H3660_SIAL; Tecquinol; SMR000059154; Hydrochinon; 1,4-Dihydroxybenzen [Czech]; Tequinol; Tretinoin, hydroquinone, and fluocinolone acetonide; HT1014_SIGMA; AIDS000964; NCGC00015523-01; 1,4-Diidrobenzene; AI3-00072; Usaf ek-356; Hydroquinole; 1,4-Dihydroxy-benzeen [Dutch]; 57534-13-1; Tenox HQ; SPBio_001883; DivK1c_006865; Black and White Bleaching Cream; KBio1_001809; Hydroquinone / tretinoin / fluocinolone; Spectrum3_000656; HYDROQUINONE; Artra; 1,4-Dihydroxy-benzol [German]; Hydrochinon [Czech, Polish]; KBio3_001511; 1,4-Dihydrobenzoquinone; LS-187959; 4-Hydroxyphenol; NCGC00090880-03; SCHEMBL4934871; HYDROP; KBio2_007373; Lopac-H-9003; Pyrogentistic acid; Benzene, p-dihydroxy-; 1,4-Hydroxybenzene; Benzoquinol; Hidroquinone; NSC9247; Eldopaque; para-Hydroxyphenol |
C6H6O2 |
110.11 g/mol |
C1=CC(=CC=C1O)O |
|
TCMBANKIN058270 |
p-quinone;Quinone |
Chinon [Dutch, German]; EPA Pesticide Chemical Code 059805; p-Benzoquinone; 54560-36-0; 1,4-Dioxy-benzol; 1,4-Diossibenzene; Benzo-chinon; Lopac-B-1266; 1,4-Diossibenzene [Italian]; Lopac0_000120; EINECS 203-405-2; benzo-1,4-quinone; UN2587; HSDB 1111; USAF P-220; 3225-29-4; 106-51-4; C15602; Benzo-chinon [German]; 1,4-Cyclohexadienedione; NSC36324; c0261; 1,4-Dioxy-benzol [German]; 1,4-Benzoquinone; Caswell No. 719C; RCRA waste no. U197; Steara pbq; 19052-63-2; quinone; p-Quinone; Semiquinone anion; AIDS-000153; 1,4-Benzoquine; para-Quinone; WLN: L6V DVJ; CHEBI:16509; Chinone; semiquinone radicals; C00472; B10358_ALDRICH; 1,4-Cyclohexadiene dioxide; InChI=1/C6H4O2/c7-5-1-2-6(8)4-3-5/h1-4; CCRIS 933; p-Chinon [German]; Cyclohexadienedione; 2,5-Cyclohexadiene-1,4-dione; Benzoquinone; 1,4-Dioxybenzene; Cyclohexadiene-1,4-dione; RCRA waste number U197; Quinone1,4-Benzoquinone; cyclohexa-2,5-diene-1,4-dione; NCGC00015139-01; NCGC00091053-01; 12309_FLUKA; p-Chinon; NCI-C55845; para-Benzoquinone; AI3-09068; Benzoquinone [UN2587] [Poison]; 1,4-Benzochinon; EU-0100120; NSC 36324; 2,5-Cyclohexadiene-1,4-dione, radical ion(1-); 51226-74-5; AIDS000153 |
C6H4O2 |
108.09 g/mol |
C1=CC(=O)C=CC1=O |
|
TCMBANKIN058276 |
2-aminobenzoic acid |
ortho-Aminobenzoic acid; anthranilic acid; vitamin L1; A89855_ALDRICH; BRN 0471803; 1321-11-5; NSC144; NSC3937; ANTHRANILATE; 2-Carboxyphenylamine; 6AB; NSC 173996; InChI=1/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10; Anthranilic acid-ring-UL-14C; 2-AA; o-Anthranilic acid; o-Carboxyaniline; 14342-65-5; NCGC00091175-01; Caswell No. 033G; EINECS 204-287-5; 2-aminobenzoic acid; NSC 144; BENZOIC ACID,2-AMINO ANTHRANILIC ACID; anthranilic acid; 80206-34-4; 304557_SIGMA; CHEBI:30754; NCI-C01730; alpha-Aminobenzoic acid; Benzoic acid, amino- (8CI)(9CI); 2-Aminobenzoic-ring-ul-14C acid; 1-Amino-2-carboxybenzene; BE2; 10680_FLUKA; C00108; AI3-02408; 2-Carboxyaniline; AIDS-020028; Benzoic acid, 2-amino-; WLN: ZR DVQ; AIDS020028; 6-AMINOBENZOIC ACID; SBB007560; EINECS 215-310-3; NSC40929; NCIOpen2_001191; o-aminobenzoic acid; Benzoic acid, o-amino-; CCRIS 49; Kyselina o-aminobenzoova [Czech]; 10678_FLUKA; Oprea1_390012; 118-92-3; Kyselina anthranilova [Czech]; HSDB 1321 |
C7H7NO2 |
137.14 g/mol |
C1=CC=C(C(=C1)C(=O)O)N |
|
TCMBANKIN058281 |
NK |
90-02-8; 2-HYDROXY-BENZALDEHYDE; 03273_FLUKA; 27761-48-4; Salicylal; C06202; Salizylaldehyd; 4-08-00-00176 (Beilstein Handbook Reference); Salicyladehyde; Salicylic aldehyde; c0337; AIDS-017916; InChI=1/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9; HSDB 721; o-Formylphenol; CHEBI:16008; Benzaldehyde, 2-hydroxy-; Benzaldehyde, o-hydroxy-; ZINC00896073; W300403_ALDRICH; S356_ALDRICH; CCRIS 7451; WLN: VHR BQ; NSC 49178; ST5213374; AIDS017916; NSC187662; AI3-02174; 2-Hydroxybenzaldehyde; 84160_FLUKA; FEMA No. 3004; o-Hydroxybenzaldehyde; 2-Formylphenol; NSC49178; BRN 0471388; EINECS 201-961-0; Salicylaldehyd; Salicylaldehyde |
C7H6O2 |
122.12 g/mol |
C1=CC=C(C(=C1)C=O)O |
|
TCMBANKIN058282 |
2-hydroxyphenyl acetic acid |
2-hydroxyphenyl aceticacid;OHP;(2-Hydroxyphenyl)acetic acid; EINECS 210-393-2; o-Hydroxy phenylacetic acid; NSC 62000; 2-Hydroxybenzeneacetic acid; Acetic acid, (o-hydroxyphenyl)-; Acetic acid, (o-hydroxyphenyl)- (8CI); 2-(2-hydroxyphenyl)ethanoic acid; (2-HYDROXYPHENYL)-ACETIC ACID; O-HYDROXYPHENYLACETIC ACID; 2-Hydroxyphenylacetate; 2-Hydroxyphenyl acetic acid; (o-Hydroxyphenyl)acetic acid; SB 01717; Hydroxyphenylacetic acid; NSC62000; 2-Hydroxyphenylacetic acid; C05852; 614-75-5; Benzeneacetic acid, 2-hydroxy-; 56120_FLUKA; 2-(2-hydroxyphenyl)acetic acid; H49804_ALDRICH; InChI=1/C8H8O3/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4,9H,5H2,(H,10,11 |
C8H8O3 |
152.15 g/mol |
C1=CC=C(C(=C1)CC(=O)O)O |
|
TCMBANKIN058283 |
MELILOTATE |
C01198; 3-(2-hydroxyphenyl)propanoic acid; 3-(2-Hydroxyphenyl) propanoic acid; Melilotic acid; Oprea1_380863; 495-78-3; 3-(o-Hydroxyphenyl) propionic acid; 3-(2-Hydroxyphenyl) propionate; 2-hydroxybenzenepropanoic acid; 393533_ALDRICH; Benzenepropanoic acid, 2-hydroxy-; 3-(2-hydroxyphenyl)propanoate; InChI=1/C9H10O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-4,10H,5-6H2,(H,11,12; AIDS017764; AIDS-017764; ST5406932; 3-(2-Hydroxyphenyl)propionic acid; o-Hydroxyphenylpropionic acid; .beta.-(O-Hydroxyphenyl)propionic acid; CHEBI:16104; |
C9H10O3 |
166.17 g/mol |
C1=CC=C(C(=C1)CCC(=O)O)O |
|
TCMBANKIN058287 |
ortho-aminophenol |
AC1Q52A5; SBB040832; 2-Aminophenyl alcohol; MolPort-000-871-989; Zoba 3GA; 82735-EP2298758A1; BASF ursol 3GA; 2-Amino-1-hydroxybenzene; 1-Amino-2-hydroxybenzene; 1-Hydroxy-2-aminobenzene; CCRIS 4144; Phenol, o-amino-; CS-D1201; LABOTEST-BB LTBB000484; ZINC00157526; ANW-40536; NCGC00091188-01; STK286021; CI Oxidation Base 17; NSC1534; BIDD:GT0801; DB01726; 2-amino-phenol; EINECS 202-431-1; 2-Hydroxyaniline; 51-19-4 (hydrochloride); RTR-032625; AI3-09065; Mesalazine impurity C, European Pharmacopoeia (EP) Reference Standard; ST2409589; 2-Aminobenzenol; c0316; I01-4364; WLN: ZR BQ; DF10085; 51204-EP2377843A1; TRA0027746; SMR001372016; 2-Aminophenol (Mesalazine Impurity C - PhEur), Pharmaceutical Secondary Standard; Certified Reference Material; KSC206E4P; UNII-23RH73DZ65; Fouramine OP; AC1L1L62; ST50214414; 95-55-6; ZINC157526; NSC-1534; Tox21_200932; 51204-EP2270006A1; CI 76520; Benzofur GG; KS-00000XEM; DB-024292; DSSTox_GSID_24498; 82735-EP2305664A1; 23RH73DZ65; AZ0001-0117; o-Hydroxyphenylamine; TIMTEC-BB SBB040832; Nako Yellow 3GA; MLS002454422; AC1Q516Y; Questiomycin B; 2-Aminophenol, purum, >=98.0% (HPLC); CJ-01678; AN-24323; 2-HYDROXYLANILINE; AKOS BBS-00004290; HSDB 4246; CTK1A6247; NCGC00258486-01; M-5557; 3-bromo-1-methyl-quinolin-2-one; O-AMINOPHENL; H441; Z57127952; 2-Aminophenol, puriss., 99.5%; 2-Aminophenol; TR-032625; 51204-EP2311824A1; 2AF; 82735-EP2298759A1; RL06017; ACT07280; 8CFFFA6B-6ACF-4377-B782-47586CF00CCB; 2-AMINO-PHENOLE; O-Amino phenol; o-Hydroxyaniline; 2-Amino-1-hydroxybenzene; Nako Yellow ga; InChI=1/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H; Epitope ID:128160; 82735-EP2292608A1; A0335; HMS3039N03; Paradone Olive Green B; 36683_RIEDEL; STR00335; LS-1981; CHEBI:18112; O-AMINOPHENOL; C.I. Oxidation Base 17; 51204-EP2371803A1; UNII-LST7140D72 component CDAWCLOXVUBKRW-UHFFFAOYSA-N; 2-amino-hydroxybenzene; NCGC00091188-03; AJ-15048; bmse000310; UN2512; F2190-0437; 2-amino phenol; C.I. 76520; NCGC00091188-02; 27598-85-2; o-Hydroxyaniline; DSSTox_CID_4498; EBD1686; 2-aminohydroxybenzene; W-100162; SC-22377; AS00211; MCULE-7578442073; MFCD00007690; ACMC-209rze; DTXSID8024498; Mesalamine Impurity C; EXPT00102; FT-0611259; amino-phenol; 2-Aminophenol, 99%; SCHEMBL24436; o-Aminophenol [UN2512] [Poison]; ORTHO AMINO PHENOL; UN 2512 (Related); 51204-EP2278637A1; DSSTox_RID_77428; AK-86065; EC 202-431-1; 2-Aminophenol, PESTANAL(R), analytical standard; NSC 1534; CAS-95-55-6; CDAWCLOXVUBKRW-UHFFFAOYSA-N; AKOS000119785; Benzene, 1-hydroxy-2-amine-; o-Aminophenol [UN2512] [Poison]; 2-Hydroxyanaline; 82735-EP2295432A1; ZB006712; CHEMBL28319; Pelagol Grey GG; Pelagol 3GA; C01987; KB-20799; AB1002390; Phenol, 2-amino-; BG01496300 |
C6H7NO |
109.13 g/mol |
C1=CC=C(C(=C1)N)O |
|
TCMBANKIN058291 |
WLN: ZVR |
HSDB 6360; Phenylcarboxamide; Benzenecarboxamide; 4-09-00-00725 (Beilstein Handbook Reference); 399337_ALDRICH; BENZOIC ACID,AMIDE; Amid kyseliny benzoove; 135828_ALDRICH; AIDS-018394; InChI=1/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9; STK069333; MLS000069472; Benzoic acid amide; ZINC00152996; ARONIS003511; AI3-01031; 27208-38-4; Amid kyseliny benzoove [Czech]; AIDS018394; NCGC00091355-01; Phenyl Carboxyamide; Phenylcarboxyamide; C09815; Benzamide; NSC3114; 55-21-0; CHEBI:28179; NSC 3114; NCGC00015142-01; Lopac-B-2009; BRN 0385876; Lopac0_000160; EINECS 200-227-7; EU-0100160; Benzoylamide; 150762_ALDRICH; CCRIS 4594; c0368; SMR000059089;benzamide |
C7H7NO |
121.14 |
C1=CC=C(C=C1)C(=O)N |
|
TCMBANKIN058293 |
BOX |
FEMA No. 2131; Benzenemethanoic acid; Retardex; Caswell No. 081; LS-280; Benzeneformic acid; benzoic acid; 1863-63-4 (AMMONIUM SALT); E 210; 65-85-0; 109479_SIAL; benzenecarboxylic acid; Benzoic acid (TN); NSC7918 (AMMONIUM SALT); AI3-03710; WLN: QVR; BEZ; 582-25-2 (POTASSIUM SALT); Kyselina benzoova; 33047_RIEDEL; C00180; Flowers of benzoin; HSDB 704; W213128_ALDRICH; ST5213864; nchembio.2007.22-comp2; C03096; D00038; B8027_SIGMA; Kyselina benzoova [Czech]; InChI=1/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9; EPA Pesticide Chemical Code 009101; Benzoesaeure [German]; Benzoesaeure; 18102_RIEDEL; Benzoic acid [USAN:JAN]; W213101_ALDRICH; 8013-63-6; Dracylic acid; Unisept BZA; AIDS-018010; phenylformic acid; Benzoic acid (JP15/USP); 47849_SUPELCO; Retarder BA; Aromatic hydroxy acid; B2670_SIGMA; CHEBI:30746; B2920_SIGMA; Mettler Toledo Calibration substance ME 18555, Benzoic acid; CCRIS 1893; Benzoesaeure GV; Acido benzoico [Italian]; Benzoic acid (natural); NSC149; Benzoic acid-ring-UL-14C; Benzoesaeure GK; Acide benzoique; Flowers of benjamin; Benzoic acid, tech.; AI3-0310; HA 1 (acid); Salvo liquid; Acide benzoique [French]; 12353_FLUKA; Tenn-Plas; Carboxybenzene; 242381_SIAL; Salvo, liquid; AIDS018010; Phenylcarboxylic acid; NCGC00091886-01; Solvo powder; 427608_ALDRICH; Benzoic acid (7CI,8CI,9CI); 33045_RIEDEL; HA 1; 73983_FLUKA; Solvo, powder; Benzoate (VAN); NSC 149; EINECS 200-618-2;benzenecarboxylic acid |
C7H6O2 |
122.12 |
C1=CC=C(C=C1)C(=O)O |
|
TCMBANKIN058301 |
Hydroxy benzyl alcohol |
|
C7H8O2 |
124.14 g/mol |
C1=CC=C(C=C1)C(O)O |
|
TCMBANKIN058314 |
benzaldehyde |
SCHEMBL896024; A804633;Benzoic aldehyde;WLN: VHR;InChI=1/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6; CHEBI:17169; Benzene methylal; B1334_ALDRICH; Ald3-H_000012; Benzenecarbonal; Benzaldehyde (natural); NCGC00091819-01; AI3-09931; EINECS 202-860-4; Oil of Bitter Almond; ST5213372; Artificial essential oil of almond; nchembio814-comp15; LS-27; EPA Pesticide Chemical Code 008601; BENZALDEHYDE; W212709_ALDRICH; Ald3.1-H_000160; D02314; Benzenemethylal; NCI-C56133; HSDB 388; 12010_FLUKA; Ald3.1-H_000479; Benzaldehyde FFC; W212717_ALDRICH; Benzene carbaldehyde; CCRIS 2376; 100-52-7; Benzaldehyde [UN1990] [Class 9]; Caswell No. 076; Benzenecarboxaldehyde; Benzoyl hydride; Ald3.1-H_000798; Benzaldehyde (NF); Artificial Almond Oil; Benzaldehyde [USAN]; Artificial Bitter Almond Oil; 09143_FLUKA; C00261; Synthetic oil of bitter almond; FEMA No. 2127; ghl.PD_Mitscher_leg0.170; c0279; 418099_ALDRICH; Benzoic aldehyde; Benzene carboxaldehyde; benzanoaldehyde; Bitter almond oil, synthetic; UN1990; NSC7917; Almond Artificial Essential Oil; NSC 7917; Benzadehyde; Phenylmethanal |
C7H6O |
106.12 |
C1=CC=C(C=C1)C=O |
|
TCMBANKIN058332 |
aurantiamide;N-[(1S)-1-(benzyl)-2-[[(1S)-1-(benzyl)-2-hydroxy-ethyl]amino]-2-keto-ethyl]benzamide |
58115-31-4; N-[(2S)-1-[[(2S)-1-hydroxy-3-phenyl-propan-2-yl]amino]-1-oxo-3-phenyl-propan-2-yl]benzamide; N-[(2S)-1-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]benzamide; N-[(1S)-2-[[(1S)-1-(hydroxymethyl)-2-phenylethyl]amino]-2-oxo-1-(phenylmethyl)ethyl]benzamide; N-[(1S)-2-[[(1S)-1-(hydroxymethyl)-2-phenyl-ethyl]amino]-2-oxo-1-(phenylmethyl)ethyl]benzamide |
C25H26N2O3 |
402.5 g/mol |
C1=CC=C(C=C1)CC(CO)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3 |
|
TCMBANKIN058336 |
phenyl propionitrile |
Phenethyl cyanide; 645-59-0; Phenylpropionitrile; ZINC01747831; 3-Phenylpropiononitrile; NSC16936; .beta.-Phenylpropionitrile; BRN 0636348; 4-09-00-01764 (Beilstein Handbook Reference); 3-Phenylpropionitrile; AI3-23733; BENZENEPROPANENITRILE; Hydrocinnamonitrile; Benzenepropionitrile; EINECS 211-447-8; Hydrocinnamique nitrile [French]; 171573_ALDRICH; NSC 16936; (2-Cyanoethyl)benzene; InChI=1/C9H9N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7H; 2-Phenylethyl cyanide; 3-Phenylpropanenitrile |
C9H9N |
131.17 g/mol |
C1=CC=C(C=C1)CCC#N |
|
TCMBANKIN058339 |
3-PhenylpropionicAcid |
hydrocinnamic acid; Benzenepropanoic acid; HCI; phenylpropionic acid; InChI=1/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11; Benzenepropionic acid; Dihydrocinnamic acid; 4-09-00-01752 (Beilstein Handbook Reference); 135232_ALDRICH; W288918_ALDRICH; 3-phenylpropionic acid; BETA-PHENYLPROPIONIC ACID; CCRIS 3199; Hydrocinnamic acid (8CI); NSC9272; Benzenepropanoic acid; AI3-00892; FEMA No. 2889; 56670_FLUKA; .beta.-Phenylpropionic acid; Phenylpropanoic acid; AIDS-110926; 501-52-0; 3-Phenylpropanoic acid; beta-Phenylpropioic acid; Benzylacetic acid; Phenylpropionic acid; C05629; BRN 0907515; NSC 9272; ST5308541; Phenylpropanoate; 3-Phenyl-propionic acid; EINECS 207-924-5; AIDS110926 |
C9H10O2 |
150.17 g/mol |
C1=CC=C(C=C1)CCC(=O)O |
|
TCMBANKIN058342 |
benzenepropanal |
NSC9271; Propionaldehyde, phenyl-; 3-Phenylpropionaldehyde; 56660_FLUKA; 3PL; 104-53-0; 4-07-00-00692 (Beilstein Handbook Reference); EINECS 215-620-9; 3-Phenylpropylaldehyde; dl-2-Phenylpropionaldehyde; 719304-66-2; W288705_ALDRICH; NSC 9271; HYDROCINNAMALDEHYDE; SBB006730; Propanal, phenyl-; Benzylacetaldehyde; 1335-10-0; Dihydrocinnamaldehyde; Hydrocinnamylaldehyde; 3-Phenyl-1-propanal; EINECS 203-211-8; 393193_ALDRICH; Phenylpropionaldehyde; InChI=1/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H; .beta.-Phenylpropionaldehyde; BRN 1071910; AI3-01377; beta-Phenylpropionaldehyde; 3-Phenylpropanal; FEMA No. 2887; Benzenepropanal; WLN: VH1UU1R; ZINC01699889; UPCMLD00WV-107; Hydrocinnamic aldehyde; Propionaidehyde, 3-phenyl-; 3-Phenylpropyl aldehyde;3-phenylpropanal;WLN: VH2R |
C9H10O |
134.17 g/mol |
C1=CC=C(C=C1)CCC=O |
|
TCMBANKIN058353 |
WLN: VHO2R;phenyl ethyl formate |
Phenethyl formate (natural); 2-Fenylethylester kyseliny mravenci [Czech]; EINECS 203-220-7; FEMA No. 2864; AI3-18542; Benzyl carbinyl formate; W286400_ALDRICH; Phenylethyl formate; ST5409324; BRN 2044524; 2-phenylethyl methanoate; Benzeneethanol, formate; FORMIC ACID, PHENETHYL ESTER; Benzylcarbinyl formate; NSC 404456; Benzylcarbinyl methanoate; 2-Phenethyl formate; .beta.-Phenylethyl formate; NSC404456; 2-Phenethyl methanoate; 104-62-1; Phenyl ethyl formate; .beta.-Phenethyl formate; Phenethyl alcohol, formate (8CI); Phenethyl alcohol, formate; Phenethyl formate; 2-Phenylethyl formate; formic acid 2-phenylethyl ester; Formic acid, 2-phenylethyl ester |
C9H10O2 |
150.17 g/mol |
C1=CC=C(C=C1)CCOC=O |
|
TCMBANKIN058354 |
Urogran |
NSC 118976; CHEBI:17484; benzyl isothiocyanate; NCIMech_000859; CHEBI:17484; KBio1_001724; (isothiocyanatomethyl)-benzene; MFCD00004819; UNII-871J6YOR8Q; KBioGR_001358; I0224; LS-7216; Benzene, (isothiocyanatomethyl)-; TR-033289; Isothiocyanatomethyl)benzene; Benzyl mustard oil; NCGC00094982-03; Spectrum_001820; KSC250O3D; AC1Q7EX9; KS-00000V2U; FT-0622167; 622-78-6; KBio2_007457; NSC-118976; ZINC1529592; HMS1921P18; KBio2_004889; Spectrum2_000852; DSSTox_RID_75407; Isothiocyanic Acid Benzyl Ester; CTK1F0731; NSC-758206; AB 2 (VAN); SCHEMBL44145; DB-022613; F0001-1663; DSSTox_CID_155; CCG-35868; Urogran; Pharmakon1600-01503006; KS-00001PQO; SPECTRUM1503006; Isothiocyanotaomethylbenzene; Benzene, isothiocyanatomethyl-; Spectrum5_001837; isothiocyanatomethyl-benzene; CJ-23924; Benzyl-isothiocyanate; DTXSID0020155; AB 2; phenylmethyl isothiocyanate; BRN 0386135; isothiocyanato-methyl-benzene; OTAVA-BB 1055640; AS04379; Benzylsenfoel [German]; AC1L1DH3; NSC118976; SBB002731; Tromalyt; alpha-Isothiocyanato-Toluene; WLN: SCN1R; Tromacaps; (Isothiocyanatomethyl)benzene; DSSTox_GSID_20155; ST50214559; 871J6YOR8Q; 1-(isothiocyanatomethyl)benzene; NSC758206; (Isothiocyanatomethyl)benzene, 9CI; Benzyl isothio cyanate; QTL1_000013; SBI-0052749.P002; CCRIS 3145; MCULE-5989558191; Toluene, alpha -isothiocyanato-; STK399787; 58019-05-9; NCIMech_000859; Isothiocyanic acid, benzyl ester; SDCCGMLS-0066697.P001; Spectrum4_001059; BITC, 17; TIMTEC-BB SBB002731; benzyl isothio cyanate; SR-05000002381; NCGC00094982-01; (Isothiocyanatomethyl)benzene #; a-isothiocyanatotoluene; CHEMBL55285; AI3-02736; EINECS 210-753-9; NCI60_000455; Benzyl isothiocyanate, 98%, FG; Tromocaps; AKOS000212138; NCGC00258743-01; Tromalyt active substance; KB-75435; PMITC cpd; ANW-34134; J-650076; MolPort-000-147-097; NCGC00094982-04; DivK1c_006780; alpha-isothiocyanatotoluene; Benzylisothiocyanate; RTR-033289; benzylisothiocyanate; NSC 118976; TL8004089; KBio2_002321; ZERO/008132; AC1Q7EYE; BBL013129; AKOS BBS-00004442; Spectrum3_000793; BDBM50240520; CAS-622-78-6; C03098; SPBio_000863; ACMC-209n1k; BB_SC-6549; KBio3_001746; I09-2433; BSPBio_002526; SR-05000002381-2; PubChem14549; isothiocyanatomethylbenzene; SpecPlus_000684; SC-13625; Benzyl isothiocyanate, analytical standard; Benzylsenfoel; Toluene, alpha-isothiocyanato-; Benzylsenfoel (german); AKOS JY2090023; LS11773; 4-12-00-02276 (Beilstein Handbook Reference); SR-05000002381-1; phenylmethanisothiocyanate; Toluene, .alpha.-isothiocyanato-; KBioSS_002323; Benzyl isothiocyanate, 98%; MDKCFLQDBWCQCV-UHFFFAOYSA-N; Tox21_201191; BITC; Benzyl isothiocyanate; NCGC00094982-02; AB00053249_03; FEMA 4428; BP-12924; KBio1_001724; KBio2_002321; (isothiocyanatomethyl)benzene; KBioGR_001358; Isothiocyanic acid, benzyl ester; ZERO/008132; Spectrum3_000793; Spectrum4_001059; SDCCGMLS-0066697.P001; C03098; SPECTRUM1503006; Benzene, (isothiocyanatomethyl)-; SPBio_000863; NCGC00094982-01; KBio3_001746; Spectrum5_001837; ZINC01529592; Benzyl mustard oil; Benzyl-isothiocyanate; AI3-02736; EINECS 210-753-9; BSPBio_002526; BRN 0386135; NCI60_000455; isothiocyanatomethylbenzene; SpecPlus_000684; Benzylsenfoel [German]; Spectrum_001820; NSC118976; Tromalyt; Toluene, alpha-isothiocyanato-; Benzylsenfoel; WLN: SCN1R; CCRIS 3145; Tromacaps; 4-12-00-02276 (Beilstein Handbook Reference); KBio2_007457; 622-78-6; Toluene, .alpha.-isothiocyanato-; KBioSS_002323; KBio2_004889; Spectrum2_000852; 252492_ALDRICH; Benzyl isothiocyanate; NCGC00094982-02; 13505_FLUKA; DivK1c_006780; AB 2 (VAN); Benzyl isothio cyanate; QTL1_000013; Benzylisothiocyanate; W510548_ALDRICH |
C8H7NS |
149.21 g/mol |
C1=CC=C(C=C1)CN=C=S |
|
TCMBANKIN058355 |
Aromatic alcohol |
NSC 8044; Aromatic primary alcohol; HSDB 46; alpha-hydroxytoluene; benzyl alcohol; AIDS009274; AIDS-009274; CCRIS 2081; Alcohol bencilico [INN-Spanish]; (Hydroxymethyl)benzene; W213705_ALDRICH; AI3-01680; FEMA No. 2137; 4-06-00-02222 (Beilstein Handbook Reference); Hydroxytoluene; benzenemethanol; Benzyl alcohol (JP15/NF/INN); 24122_RIEDEL; 442481_SUPELCO; Phenolcarbinol; NCGC00091865-01; InChI=1/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H; Euxyl K 100; .alpha.-Toluenol; BENZYL-ALCOHOL; Caswell No. 081F; BRN 0878307; Benzoyl alcohol; C00556; Benzal alcohol; 402834_SIAL; 100-51-6; 1336-27-2; LS-307; Phenylcarbinolum; Methanol, phenyl-; 305197_ALDRICH; NSC8044; c0278; Benzyl alcohol (natural); 185532-71-2; Benzenecarbinol; hydroxymethylbenzene; C03485; Alcool benzilico [DCIT]; NCI-C06111; TOLUENE,ALPHA-HYDROXY; 108006_ALDRICH; Benzylalkohol; alpha-Toluenol; 13160_FLUKA; Benzyl alcohol [USAN:INN:JAN]; EINECS 202-859-9; CHEBI:17987; Alcoholum benzylicum [INN-Latin]; EPA Pesticide Chemical Code 009502; phenylcarbinol; 34460_RIEDEL; .alpha.-Hydroxytoluene; Benzylicum; D00077; W213713_ALDRICH; alcoholum benzylicum; benzylalcohol; phenylmethanol; Phenylmethyl alcohol; benzylic alcohol; Alcool benzylique; Alcool benzylique [INN-French];benzyl alcohol;WLN: Q1R |
C7H8O |
108.14 g/mol |
C1=CC=C(C=C1)CO |
|
TCMBANKIN058360 |
Tropeolin |
Benzyl rhodanide; EINECS 221-144-2; Benzylrhodonid; Thiocyanic acid, phenylmethyl ester; WLN: NCS1R; 3012-37-1; Benzyl-thiocyanate; B32009_ALDRICH; STK331791; ZINC01529490; Solvat 14; AJ-087/40225997; alpha-Thiocyanatotoluene; NSC1729; Toluene, alpha-thiocyanato-; AI3-08887; NSC 130266; NSC130266; thiocyanatomethylbenzene; Toluene, .alpha.-thiocyanato-; InChI=1/C8H7NS/c9-7-10-6-8-4-2-1-3-5-8/h1-5H,6H; Benzyl thiocyanate; CCRIS 3085; CHEBI:16017; BRN 1859726; 13929_FLUKA; C02660; Benzylthiocyanate; NSC 1729; Thiocyanic acid, benzyl ester; 4-06-00-02680 (Beilstein Handbook Reference); .alpha.-Thiocyanatotoluene; phenylmethyl thiocyanate;benzyl thiocyanate;benzyl thiocyanate |
C8H7NS |
149.21 g/mol |
C1=CC=C(C=C1)CSC#N |
|
TCMBANKIN058396 |
Leukol |
Benzopyridine (VAN); Quinoline; EINECS 202-051-6; HSDB 121; Chinoleine; 20214-07-7; 2,3-Benzopyridine; Benzopyridine; NCIOpen2_007906; Chinolin [Czech]; CHEBI:17362; 15305_RIEDEL; Quinoline (8CI,9CI); Chinolin; NSC3396; Benzo(b)pyridine; B 500; WLN: T66 BNJ; InChI=1/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7; AI3-01241; 241571_ALDRICH; ZINC01706876; CCRIS 547; 1-Benzazine; B-500; AIDS020530; AIDS-020530; Quinoline [UN2656] [Poison]; UN2656; Usaf ek-218; 91-22-5; Benzo[b]pyridine; FEMA No. 3470; NCGC00091190-01; Chinoline; Leucol; AE-641/01960007; W347000_ALDRICH; 1-Azanaphthalene; 1-Benzine; Q1255_ALDRICH; NSC 3396; Quinolin; C06413; quinoline |
C9H7N |
129.16 g/mol |
C1=CC=C2C(=C1)C=CC=N2 |
|
TCMBANKIN058398 |
BZF |
WLN: T56 BOJ; NCGC00091088-01; 1-Oxindene; 1-Oxidene; NCGC00091088-03; CCRIS 2384; Coumaron; Benzo(b)furan; NSC 1255; InChI=1/C8H6O/c1-2-4-8-7(3-1)5-6-9-8/h1-6; EINECS 205-982-6; Cumarone; FR-0548; Benzo[b]furan; Benzofuran (IUPAC); 1-benzofuran; Coumarone; ZINC01591814; CHEBI:35260; HSDB 4173; Benzofuran; Benzofurfuran; B8002_ALDRICH; BRN 0107704; AI3-17613; SB 00762; 271-89-6; NSC1255; 5-17-02-00003 (Beilstein Handbook Reference); 2,3-Benzofuran; NCGC00091088-02; NCI-C56166; C14512 |
C8H6O |
118.13 g/mol |
C1=CC=C2C(=C1)C=CO2 |
|
TCMBANKIN058399 |
1,2-benzisothiazole |
1,2-benzothiazole;1,2-BENZISOTHIAZOLE; CCRIS 6347; 272-16-2; Benzo[d]isothiazole |
C7H5NS |
135.19 g/mol |
C1=CC=C2C(=C1)C=NS2 |
|
TCMBANKIN058407 |
THZ |
NCGC00091399-01; EINECS 202-396-2; NSC 8040; FEMA Number 3256; AIDS-019689; FEMA No. 3256; Benzosulfonazole; BOT; c1128; 128366-28-9; ZINC00019726; o-2857; Vangard BT; 4-27-00-01069 (Beilstein Handbook Reference); AIDS019689; AC-907/25014160; W325600_ALDRICH; 101338_ALDRICH; 95-16-9; NSC8040; Benzothiazol; CCRIS 7893; HSDB 2796; BENZOTHIAZOLE; 1,3-benzothiazole; CHEBI:45993; InChI=1/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5; WLN: T56 BN DSJ; Usaf ek-4812; 12797_FLUKA; AI3-05742; BRN 0109468; 1-Thia-3-azaindene; 4-Benzothiazol-2-yl-2-methyl-phenylamine; MLS002702269; cid_384525; 4-Benzothiazol-2-yl-2-methyl-phenyl amine; BB 0245167; MCULE-2465361022; 4-(benzo[d]thiazol-2-yl)-2-methylbenzenamine; 2-(4'-amino-3'-methylphenyl)benzothiazole; T6913; NSC674495; LS-28095; STK027735; BAS 06856403; ZINC6701; EN300-231774; Benzothiazole, 2-(4-amino-3-methylphenyl)-; SBB007298; BB_SC-0831; MFCD00950805; CHEMBL11825; AC1L8NN0; IDBCUMFOZBUJCL-UHFFFAOYSA-N; BBL008089; MolPort-000-810-817; HMS3433D11; 4-(1,3-benzothiazol-2-yl)-2-methylaniline; ZB000649; 178804-04-1; CTK0E3411; SMR001565831; SR-01000319885; DF-203; BDBM50141278; 2-(4-amino-3-methylphenyl)benzothiazole; AKOS000108517; [4-(1,3-benzothiazol-2-yl)-2-methylphenyl]amine; NCI60_026383; NSC-674495; SR-01000319885-1; DTXSID30327656; SCHEMBL1326042; BB_SC-00831; 4-benzothiazol-2-yl-2-methylphenylamine; 4-(3H-1lambda*4*-Benzothiazol-2-yl)-2-methyl-phenylamine; ST077878; Benzenamine, 4-(2-benzothiazolyl)-2-methyl-; Benzenamine, 4-(benzothiazol-2-yl)-2-methyl-; AK619236; 4-(benzo[d]thiazol-2-yl)-2-methylaniline; CCG-35258; ZERO/005854; IMED57809015; benzothiazole |
C7H5NS |
135.19 |
C1=CC=C2C(=C1)N=CS2 |
|
TCMBANKIN058433 |
2- Minaline |
2-minaline; 634-97-9; Pyrrole-2-carboxylic acid; AC-907/25014066; 1H-Pyrrole-2-carboxylic acid (9CI); 1H-Pyrrole-2-carboxylic acid; 83235_FLUKA; EINECS 211-221-9; AIDS-019601; CHEBI:36751; NSC48130; 2-Pyrrolecarboxylic acid; 83237_FLUKA; P73609_ALDRICH; SBB004332; 2-Minaline; C05942; Minalin; AIDS019601; NSC 48130; Minaline; PYC |
C5H5NO2 |
111.1 g/mol |
C1=CNC(=C1)C(=O)O |
|
TCMBANKIN058439 |
FOA |
2-furoic acid;Furoate;AI3-16500; .alpha.-Furoic acid; F20505_ALDRICH; .alpha.-Furancarboxylic acid; FUROIC ACID; 48000_FLUKA; furan-2-carboxylic acid; Pyromucic acid; NSC8842; 26447-28-9; NSC 8842; alpha-Furoic acid; 2-Furoic acid [per EINECS]; BRN 0110149; 2-Furoic acid; SBB004324; InChI=1/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7; Kyselina 2-furoova [Czech]; EINECS 247-713-5; Furancarboxylic acid; alpha-Furancarboxylic acid; 2-Furancarboxylic acid; C01546; 88-14-2; CCRIS 2157; Kyselina pyroslizova [Czech]; AC-907/25014051; CHEBI:30845; 2-Carboxyfuran; EINECS 201-803-0; 5-18-06-00102 (Beilstein Handbook Reference) |
C5H4O3 |
112.08 g/mol |
C1=COC(=C1)C(=O)O |
|
TCMBANKIN058440 |
2-furancarboxaldehyde |
2-Furfuraldehyde; NCGC00091328-01; Furale; Caswell No. 466; CCRIS 1044; Nci-C56177; Fural; NSC8841; Furaldehydes [UN1199] [Poison]; LS-28; AI3-04466; EPA Pesticide Chemical Code 043301; 2-Furylcarboxaldehyde; 2-Furil-metanale [Italian]; NSC 8841; Furol; Furfural; 2-furfural; 2- Furfuraldehyde; furaldehyde; 48070_FLUKA; 2-Furylaldehyde xypropane; F1294-0048; 39276-09-0; Furfural (2-Furfurol, 2-Furaldehyde); Furfural, natural, >=98%, FCC, FG; Furfural, ACS reagent, 99%; FEMA No. 2968; CTK1B4104; Tox21_111114; Rcra waste number U125; 2-Furylcarboxaldehyde; KSC214C0J; 2-Furylaldehyde; 72277-EP2308870A2; ST50213385; EC 202-627-7; 2-furancarbaldehyde; QSPL 102; AKOS000118907; I14-0911; alpha-Furole; FURFURAL; AC1L1OL7; 2-Furil-metanale; BRN 0105755; furan-2-carboxaldehydl; Artificial ant oil; Fuf ural; BIDD:ER0698; F0073; QSPL 006; 2-Furancarbonal; 2-Furfural; WOOD VINEGAR; 2-Furaldehyde; Furfuraldehyde; 2-Furankarbaldehyd [Czech]; Furfurol; I14-22069; RL06103; 72277-EP2308867A2; CCRIS 1044; Fural; furfuraldehydl; Tox21_300170; EPA Pesticide Chemical Code 067206; KB-24259; Furaldehydes [UN1199] [Poison]; HYBBIBNJHNGZAN-UHFFFAOYSA-N; FEMA No. 2967; 2-Furil-metanale [Italian]; SC-18048; Furaldehydes; WLN: T5OJ BVH; ACMC-20978u; Furyl-methanal; 5-17-09-00292 (Beilstein Handbook Reference); Furfurylaldehyde; ZINC3861345; Furfurole; Furfurale [Italian]; UNII-N4G9GAT76C component HYBBIBNJHNGZAN-UHFFFAOYSA-N; Furaldehydes [UN1199] [Poison]; Tox21_202191; TRA0077688; 2-Furyl-methanal; CAS-98-01-1; Furfural (natural); 2-furaldehydl; EBD294; Caswell No. 904; 2-Furankarbaldehyd; 2-Furanaldehyde; FEMA No. 2489; BP-31002; Pyroligneous acids; CHEMBL189362; Artificial oil of ants; NCGC00253954-01; 2-Formylfuran; DSSTox_GSID_20647; DB-003668; Furol; NCGC00259740-01; LS-162370; 2-furan-carboxaldehyde; alpha-Furfuraldehyde; Caswell No. 466; NCGC00091328-04; Nci-C56177; Furfural, 99%; 2-FURANCARBOXALDEHYDE, ACS; LS-28; DTXSID1020647; AC1Q6PVV; AI3-04466; FEMA 2489; Fufural; furan-2-carbaldehyde; Ant Oil, artificial; Bran oil; Quakeral; Ant Oil; HSDB 542; Furane-2-carbaldehyde; STL283124; A845786; 2-Furylmethanal; ANW-13660; Furfurale; Wood Tar; RTC-069695; DSSTox_RID_75709; DJ1HGI319P; Furaldehyde; 2-Formylofuran; Furfural, for synthesis, 98.0%; UN1199; MCULE-5757882837; 2-Furancarboxaldehyde; 2-Furaldehyde, 8CI; NCGC00091328-02; Furfural, >=98%, FCC, FG; Qo furfural; furan-2-aldehyde; a-Furole; SBB004386; 2-furanal; 1998/1/1; Furale; NSC-8841; 72277-EP2277848A1; NSC8841; Furfural, SAJ first grade, >=99.0%; 2-Formyl furan; EPA Pesticide Chemical Code 043301; NSC 8841; U1199; UNII-DJ1HGI319P; EINECS 202-627-7; NCGC00091328-03; 2-Furaldehyde, 98% 250g; furan-2 carbaldehyde; Pyroligneous vinegar; CS-0015696; Furancarbonal; CHEBI:34768; a-furfuraldehyde; Furancarboxaldehyde; .alpha.-Furole; Pyromucic aldehyde; Furfuralu; Furole; RCRA waste no. U125; KS-00000WKJ; MolPort-000-871-210; EINECS 232-450-0; Furfural, analytical reference material; 2-Formylofuran [Polish]; DSSTox_CID_647; STR00358; InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4; MFCD00003229; 2-furancarboxyaldehyde; AM81812; Pyroligneous acid extract; C14279; Furan-2-carboxaldehyde; EINECS 202-627-7; furan-2-carbaldehyde; WLN: T5OJ BVH; 2-Furylaldehyde; Ant Oil, artificial; Furancarbonal; Bran oil; Furyl-methanal; 5-17-09-00292 (Beilstein Handbook Reference); Furfurylaldehyde; HSDB 542; Quakeral; Furfurole; Furfurale [Italian]; Furfurale; .alpha.-Furole; FURFURAL; Pyromucic aldehyde; ZINC03861345; 2-Furyl-methanal; 2-Furil-metanale; BRN 0105755; Furole; Furfural (natural); RCRA waste no. U125; Furaldehyde; Artificial ant oil; 2-Furaldehyde, purified; W248908_ALDRICH; 2-Formylofuran [Polish]; UN1199; 2-Furanaldehyde; FEMA No. 2489; 2-Furancarboxaldehyde; 185914_ALDRICH; 2-Furancarbonal; 2-Furfural; InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4; Artificial oil of ants; 2-Furaldehyde; RCRA waste number U125; 319910_SIAL; 2-Formylfuran; Furfuraldehyde; C14279; Furan-2-carboxaldehyde; Furfurol; SBB004386; 98-01-1; W248924_ALDRICH; 2-Furankarbaldehyd [Czech]; 2-Furylaldehyde xypropane; F1294-0048; 39276-09-0; Furfural (2-Furfurol, 2-Furaldehyde); Furfural, natural, >=98%, FCC, FG; Furfural, ACS reagent, 99%; FEMA No. 2968; CTK1B4104; Tox21_111114; Rcra waste number U125; 2-Furylcarboxaldehyde; KSC214C0J; 2-Furylaldehyde; 72277-EP2308870A2; ST50213385; EC 202-627-7; 2-furancarbaldehyde; QSPL 102; AKOS000118907; I14-0911; alpha-Furole; FURFURAL; AC1L1OL7; 2-Furil-metanale; BRN 0105755; furan-2-carboxaldehydl; Artificial ant oil; Fuf ural; BIDD:ER0698; F0073; QSPL 006; 2-Furancarbonal; 2-Furfural; WOOD VINEGAR; 2-Furaldehyde; Furfuraldehyde; 2-Furankarbaldehyd [Czech]; Furfurol; I14-22069; RL06103; 72277-EP2308867A2; CCRIS 1044; Fural; furfuraldehydl; Tox21_300170; EPA Pesticide Chemical Code 067206; KB-24259; Furaldehydes [UN1199] [Poison]; HYBBIBNJHNGZAN-UHFFFAOYSA-N; FEMA No. 2967; 2-Furil-metanale [Italian]; SC-18048; Furaldehydes; WLN: T5OJ BVH; ACMC-20978u; Furyl-methanal; 5-17-09-00292 (Beilstein Handbook Reference); Furfurylaldehyde; ZINC3861345; Furfurole; Furfurale [Italian]; UNII-N4G9GAT76C component HYBBIBNJHNGZAN-UHFFFAOYSA-N; Furaldehydes [UN1199] [Poison]; Tox21_202191; TRA0077688; 2-Furyl-methanal; CAS-98-01-1; Furfural (natural); 2-furaldehydl; EBD294; Caswell No. 904; 2-Furankarbaldehyd; 2-Furanaldehyde; FEMA No. 2489; BP-31002; Pyroligneous acids; CHEMBL189362; Artificial oil of ants; NCGC00253954-01; 2-Formylfuran; DSSTox_GSID_20647; DB-003668; Furol; NCGC00259740-01; LS-162370; 2-furan-carboxaldehyde; alpha-Furfuraldehyde; Caswell No. 466; NCGC00091328-04; Nci-C56177; Furfural, 99%; 2-FURANCARBOXALDEHYDE, ACS; LS-28; DTXSID1020647; AC1Q6PVV; AI3-04466; FEMA 2489; Fufural; furan-2-carbaldehyde; Ant Oil, artificial; Bran oil; Quakeral; Ant Oil; HSDB 542; Furane-2-carbaldehyde; STL283124; A845786; 2-Furylmethanal; ANW-13660; Furfurale; Wood Tar; RTC-069695; DSSTox_RID_75709; DJ1HGI319P; Furaldehyde; 2-Formylofuran; Furfural, for synthesis, 98.0%; UN1199; MCULE-5757882837; 2-Furancarboxaldehyde; 2-Furaldehyde, 8CI; NCGC00091328-02; Furfural, >=98%, FCC, FG; Qo furfural; furan-2-aldehyde; a-Furole; SBB004386; 2-furanal; 1998/1/1; Furale; NSC-8841; 72277-EP2277848A1; NSC8841; Furfural, SAJ first grade, >=99.0%; 2-Formyl furan; EPA Pesticide Chemical Code 043301; NSC 8841; U1199; UNII-DJ1HGI319P; EINECS 202-627-7; NCGC00091328-03; 2-Furaldehyde, 98% 250g; furan-2 carbaldehyde; Pyroligneous vinegar; CS-0015696; Furancarbonal; CHEBI:34768; a-furfuraldehyde; Furancarboxaldehyde; .alpha.-Furole; Pyromucic aldehyde; Furfuralu; Furole; RCRA waste no. U125; KS-00000WKJ; MolPort-000-871-210; EINECS 232-450-0; Furfural, analytical reference material; 2-Formylofuran [Polish]; DSSTox_CID_647; STR00358; InChI=1/C5H4O2/c6-4-5-2-1-3-7-5/h1-4; MFCD00003229; 2-furancarboxyaldehyde; AM81812; Pyroligneous acid extract; C14279; Furan-2-carboxaldehyde |
C5H4O2 |
96.08 g/mol |
C1=COC(=C1)C=O |
|
TCMBANKIN058441 |
Furfuranol |
2-Furanmethanol, homopolymer; Furfuralcohol; NCI-C56224; WLN: T5OJ B1Q; W249106_ALDRICH; UN2874; 2-Furancarbinol; 2-Hydroxymethylfuran; 2-Furfurylalkohol; FEMA No. 2491; HSDB 711; F19906_ALDRICH; 5-17-03-00338 (Beilstein Handbook Reference); furan-2-ylmethanol; (2-FURYL)-METHANOL (FURFURYLALCOHOL); NSC8843; 2-Furylmethanol; EINECS 202-626-1; 88161-36-8; 25212-86-6; .alpha.-Furylcarbinol; alpha-Furylcarbinol; Furylcarbinol; 93793-62-5; 2-Furanylmethanol; 2-Furylcarbinol; LS-2036; Furfurylcarb; 2-Furfuryl alcohol; InChI=1/C5H6O2/c6-4-5-2-1-3-7-5/h1-3,6H,4H; 98-00-0; Furfuryl alcohol [UN2874] [Poison]; FURFURYL ALCOHOL; ZINC01648266; 185930_ALDRICH; 2-Furanmethanol; 5-Hydroxymethylfuran; AI3-01171; SBB004373; NSC 8843; CCRIS 2922; .alpha.-Furfuryl alcohol; BRN 0106291; Methanol, (2-furyl)-; 2-(Hydroxymethyl)furan; Furfural alcohol; 2-Furfurylalkohol [Czech]; Furylcarbinol (VAN); Furyl alcohol; NCGC00249166-01; alpha -Furfuryl alcohol; KSC234E7N; 2-Furylmethanol (ACD/Name 4.0); CHEBI:207496; DSSTox_CID_5347; Furfuryl alcohol, 98%; 2-Hydroxymethylfuran; 2-Furfurylalkohol; XPFVYQJUAUNWIW-UHFFFAOYSA-N; 5-17-03-00338 (Beilstein Handbook Reference); Furfuryl alcohol, natural, >=95%, FG; DSSTox_GSID_25347; 2-Furylmethanol; ACMC-20aiwg; alpha-Furylcarbinol; 2-Furane-methanol (furfurol); AKOS000119178; J-521401; 2-Furylcarbinol; F0076; D582054MUH; Z940713500; Epitope ID:136037; A845784; 5-Hydroxymethylfuran; I14-7268; Furfural alcohol; NCGC00256987-01; FEMA 2491; 40795-25-3; 2-Furanmethanol, homopolymer; NCI-C56224; Tox21_202102; WLN: T5OJ B1Q; DB-016149; DSSTox_RID_77760; 2-furan carbinol; Furanmethanol; FEMA No. 2491; HSDB 711; furan-2-ylmethanol; CHEBI:53371; Tox21_303093; NSC-8843; 2-furylmethan-1-ol; Furfuryl alcohol [UN2874] [Poison]; PubChem19996; I14-22235; 25212-86-6; 88161-36-8; .alpha.-Furylcarbinol; (Fur-2-yl)methanol; Furylcarbinol; 2-Furanmethanol (furfuryl alcohol); 2-Hydroxymethyl-Furan; 2-Furane-methanol; Furfurylcarb; RL06102; InChI=1/C5H6O2/c6-4-5-2-1-3-7-5/h1-3,6H,4H; KB-52195; 98-00-0; Furfuryl alcohol [UN2874] [Poison]; FURFURYL ALCOHOL; ANW-75422; NSC 8843; 767-EP2377611A2; CCRIS 2922; AC1Q7C2H; UN 2874; 767-EP2305688A1; Methanol, (2-furyl)-; AC1L1OL4; BR-72801; AN-17685; CJ-26639; MolPort-000-872-013; 2-Furfurylalkohol [Czech]; ST50214441; furfuryl alcohol (furfurol); UN2874; 2-Furfurylalkohol(CZECH); CTK1D4276; TC-164167; CHEMBL308187; (2-FURYL)-METHANOL (FURFURYLALCOHOL); polyfurfuryl alcohol; alpha -Furylcarbinol; Furfuryl alcohol, analytical standard; 146235-13-4; poly(furfurylalcohol); 93793-62-5; MFCD00003252; (2-furyl)methanol; LS-2036; PFFA; MCULE-4977977402; UNII-D582054MUH; 2-hydroxymethylfurane; 2-Furanmethanol; Furfuryl alcohol, 8CI; (furan-2-yl)methanol; AI3-01171; EC 202-626-1; AK-72801; TR-030270; CAS-98-00-0; AM81811; 2-furanemethanol; BRN 0106291; formaldehyde copolymer; furylmethanol; DTXSID2025347; omega-hydroxypoly(furan-2,5-diylmethylene); alpha-Furfuryl alcohol; C20441; 2-Furfurylalcohol; 2-(Hydroxymethyl)furan; Furylcarbinol (VAN); Furyl alcohol; KS-00000X7F; Furfuralcohol; (2-furyl)-Methanol; 2-Furancarbinol; Furfuryl alcohol, >=97%, FG; Furan-2-methanol; ZINC1648266; EINECS 202-626-1; 2-Furanylmethanol; poly-furfuryl alcohol; Furan-2-yl-methanol; 2-Furfuryl alcohol; Furfuranol; F0001-2310; NCGC00259651-01; SBB004373; 767-EP2377849A2; .alpha.-Furfuryl alcohol; Qo furfuryl alcohol; TRANSGENIC LECM (FURFURYL ALCOHOL) (SEE ALSO FURFURYL ALCOHOL); Furfurylalcohol; STR01021; omega-hydroxypoly(furan-2,5-diylmethylene) macromolecule; 767-EP2377610A2; NSC8843; poly(furfuryl alcohol); fur-furyl alcohol |
C5H6O2 |
98.1 g/mol |
C1=COC(=C1)CO |
|
TCMBANKIN058553 |
Tropyliden |
EINECS 208-866-3; 1,3,5-CYCLOHEPTATRIENE; Tropiliden; Cycloheptatriene; 544-25-2; Cycloheptatriene [UN2603] [Flammable liquid]; C99205_ALDRICH; Cycloheptatrien; CHEBI:37519; 28858_FLUKA; Tropilidene; 1H-[7]annulene; cyclohepta-1,2,4,6-tetraene; InChI=1/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H; cyclohepta-1,3,5-triene; UN2603; Zykloheptatrien; Tropilidine; ACMC-1ALO0; LS-56137; FT-0606497; UN 2603; EINECS 208-866-3; 1,3,5-CYCLOHEPTATRIENE; AN-45795; TC-020332; W-109559; Cycloheptatriene [UN2603] [Flammable liquid]; Tropyliden; ANW-32075; AJ-33013; ZINC2034827; AK115870; SBB061185; ST51047237; Tropiliden; Cycloheptatriene; AKOS000121113; 544-25-2; ST24030275; KB-49191; cyclohepta-2,4,6-trien-1-yl; MFCD00004146; CJ-31936; STL373480; BBL027452; MCULE-6950733657; Cycloheptatriene [UN2603] [Flammable liquid]; AC1L1WET; 48854-EP2272537A2; 7866AB; 48854-EP2311841A1; Cycloheptatrien; Cycloheptatriene, 95%; CHEBI:37519; 1,3,5-Cycioheptatriene; A830174; Tropilidene; DTXSID5073909; 1H-[7]annulene; I14-8226; Cyclohepta-1,3,5-triene; BB_SC-6674; DB-052570; InChI=1/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H; CTK1C4731; Tropilidin; UN2603; Zykloheptatrien; (1,3-Cycloheptadiene-5,6-diyl)radical; Tropilidine; BG00599827; CHVJITGCYZJHLR-UHFFFAOYSA-N; MolPort-001-787-047 |
C7H8 |
92.14 g/mol |
C1C=CC=CC=C1 |
|
TCMBANKIN058554 |
Inden |
InChI=1/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H; EINECS 202-393-6; CHEBI:33052; Indenyl radical; ST5214452; CHEBI:41921; 193828_ALDRICH; WLN: L56 BHJ; 95-13-6; 9003-64-9; 71551-80-9; 168769_ALDRICH; NSC62567; Indonaphthene; 1H-Indene; NSC 9270; I2800_ALDRICH; 1H-inden-1-ylidene; Indene; NSC9270; HSDB 5286; indene |
C9H8 |
116.16 g/mol |
C1C=CC2=CC=CC=C21 |
|
TCMBANKIN058581 |
GBL |
1,4-Lactone; 2-tetrahydrofuranone; Gamma-Lactone 4-hydroxy-butyric acid; CHEBI:42639; B103608_ALDRICH; Butyric acid lactone; gamma-Hydroxybutyric acid cyclic ester; 4-Hydroxybutanoic acid, .gamma.-lactone; oxolan-2-one; 1,4-Butyrolactone; .gamma.-6480; .gamma.-Hydroxybutyric acid lactone; gamma-Hydroxybutyric acid lactone; Butanoic acid, 4-hydroxy-, .gamma.-lactone; ZINC04658567; Butyryl lactone; gamma-Butyrolactone (natural); gamma-6480; 4-Deoxytetronic acid; NSC4592; 2-Oxolanone; .gamma.-Butyrolactone; HSDB 4290; .gamma.-BL; 187997-16-6; NCI-C55878; EINECS 202-509-5; 4-Hydroxybutyric acid, .gamma.-lactone; 4-Butanolide; 4-Butyrolactone; AI3-28121; gamma-BL; tetrahydrofuran-2-one; Tetrahydro-2-furanone; NSC 4592; CCRIS 2924; EPA Pesticide Chemical Code 122303; Caswell No. 132B; FEMA No. 3291; Gamma-Lactone 4-hydroxybutanoic acid; Butyrylactone; 4-Hydroxybutanoic acid lactone; C-1070; 2(3H)-Furanone, dihydro-; C01770; 1,2-Butanolide; 3-Hydroxybutyric acid lactone; 4-Hydroxybutyric acid lactone; No Go; Dihydro-2-furanone; 1,4-Butanolide; .gamma.-Hydroxybutyric acid cyclic ester; Gamma-Butanolactone; gamma-Hydroxybutyrolactone; InChI=1/C4H6O2/c5-4-2-1-3-6-4/h1-3H; Gamma-Lactone 4-hydroxybutyric acid; .alpha.-Butyrolactone; c0033; Dihyro-2-furanone; .gamma.-Hydroxybutyrolactone; W329118_ALDRICH; BLO; Butyric acid, 4-hydroxy-, gamma-lactone; Agrisynth BLO; Butanoic acid, 4-hydroxy-, gamma-lactone; Gamma-Lactone 4-hydroxy-butanoic acid; dihydrofuran-2(3H)-one; 96-48-0; Alpha-Butyrolactone; Dihydro-2(3H)-furanone; BLON; Butyrolactone; WLN: T5OVTJ; Butyric acid, 4-hydroxy-, .gamma.-lactone; 2-Oxotetrahydrofuran; LS-2010; BUTANOIC ACID,4-HYDROXY,LACTONE GAMMA-BUTYROLACTONE; gamma-Butyrolactone; 1-Oxacyclopentane-2-one; γ- Butyrolactone; Butyrolactone |
C4H6O2 |
86.09 |
C1CC(=O)OC1 |
|
TCMBANKIN058586 |
Prolinum |
(-)-Proline (S)-2-Carboxypyrrolidine; 18875-45-1; (2S)-2-pyrrolidinecarboxylic acid; P5607_SIGMA; L-Proline-15N; AIDS018625; 4305-67-3; L-Proline, labeled with carbon-14; L-Proline (JAN); L-(-)-Proline; CHEBI:17203; 37159-97-0; Carboxypyrrolidine; P0380_SIAL; (-)-(S)-Proline; Proline (USP); D00035; NCGC00014017; W331902_ALDRICH; (2S)-pyrrolidine-2-carboxylic acid; (S)-pyrrolidine-2-carboxylic acid; L-Prolin; NSC-97923; P8865_SIAL; nchembio816-comp9; AIDS-018625; L-(2,3-3H)Proline; C00148; 4607-28-7; 81710_FLUKA; (2S)-proline; 608998_ALDRICH; 81709_FLUKA; proline |
C5H9NO2 |
115.13 g/mol |
C1CC(NC1)C(=O)O |
|
TCMBANKIN058643 |
Coumaran |
2,3-dihydro-1-benzofuran; 37281_FLUKA; 2,3-DIHYDROBENZOFURAN; EINECS 207-817-3; Benzofuran, 2,3-dihydro-; 496-16-2; InChI=1/C8H8O/c1-2-4-8-7(3-1)5-6-9-8/h1-4H,5-6H; SB 01482; 183962_ALDRICH,Kumaran |
C8H8O |
120.15 g/mol |
C1COC2=CC=CC=C21 |
|
TCMBANKIN058907 |
Azeton |
ACETONE; 673781_ALDRICH; Methyl ketone; Propanon; propan-2-one; C00207; W332615_ALDRICH; Pyroacetic acid; 40308_RIEDEL; 67-64-1; EPA Pesticide Chemical Code 004101; propanone; CHEBI:15347; dimethylcetone; ST5214392; HSDB 41; 414689_ALDRICH; Acetone [UN1090] [Flammable liquid]; 323772_ALDRICH; Chevron acetone; 320110_SIAL; c0556; 154598_SIAL; EINECS 200-662-2; Aceton [German, Dutch, Polish]; Dimethylketal; 00561_FLUKA; Dimethylketon; 34850_SIAL; 2-propanone; Acetone (TN); 179973_ALDRICH; Dimethylformaldehyde; dimethylketone; WLN: 1V1; Acetone (NF); ZINC00895111; RCRA waste number U002; 24201_RIEDEL; Aceton; RCRA waste no. U002; 179124_SIAL; 34480_RIEDEL; FEMA No. 3326; UN1090; Pyroacetic ether; Ketone, dimethyl-; 270725_ALDRICH; 534064_ALDRICH; 90872_FLUKA; Ketone, dimethyl; Caswell No. 004; 32201_RIEDEL; D02311; InChI=1/C3H6O/c1-3(2)4/h1-2H; Dimethyl ketone; AI3-01238; NCGC00091179-01; Dimethyl formaldehyde; 40289_RIEDEL; W332607_ALDRICH; Ketone propane; NSC135802; NSC 135802; .beta.-Ketopropane; beta-Ketopropane; 650501_ALDRICH; CCRIS 5953; Acetone (natural); 443638_SIAL; 439126_ALDRICH;acetone |
C3H6O |
58.08 |
CC(=O)C |
|
TCMBANKIN058910 |
1,2-propanedione,1-phenyl- |
Phenylmethyldiketone; EINECS 209-435-2; CCRIS 6297; ST5437535; Benzoyl methyl ketone; 223034_ALDRICH; ZINC01683675; FEMA No. 3226; Acetylbenzoyl; Methylphenylglyoxal; 1,2-Propanedione, 1-phenyl-; 1-Phenyl-1,2-propanedione; Acetyl benzoyl; AI3-23868; 1-phenyl-1,2-propandione; 579-07-7; 30581-69-2; W322601_ALDRICH; 3-Phenyl-2,3-propanedione; 1-Phenylpropane-1,2-dione; NSC 7643; Benzoylacetyl; InChI=1/C9H8O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6H,1H; NSC7643; Methyl phenyl diketone; Methyl phenyl glyoxal; Phenyl methyl diketone;Phenylmethyldiketone; ZINC1683675; KB-13080; DTXSID3060372; CCRIS 6297; ST45024211; W-105429; CJ-27768; FEMA No. 3226; Acetylbenzoyl; SCHEMBL8670415; LS-179806; SC-81678; 1-phenyl-1,2-propandione; AM20040761; 579-07-7; SCHEMBL180411; D02TLP; RT-002303; 1-Phenyl-1,2-propanedione, 98%, FG; BVQVLAIMHVDZEL-UHFFFAOYSA-N; 1-PHENYL-1,2-PROPANEDIONE; NSC7643; AKOS003382258; BG01498911; CJ-06351; BDBM22724; ZB5XA3GD0I; Methylphenylglyoxal; Pyruvophenone; AS-11744; AB1006062; MolPort-001-780-114; ST2415466; AN-21476; CTK3J4995; 30581-69-2; 3-Phenyl-2,3-propanedione; NSC 7643; CS-W019544; NSC-7643; Methyl phenyl diketone; 1-Phenyl-propane-1,2-dione; Phenyl methyl diketone; EINECS 209-435-2; ACMC-1ATOH; Benzoyl methyl ketone; phenyl-propane dione; 1,2-Propanedione, 1-phenyl-; CHEMBL192258; AI3-23868; 579P077; KSC494S9L; DB-003204; MFCD00008755; 4CH-014605; 1-Phenylpropane-1,2-dione; Phenyl-1,2-Propanedione; NE10607; UNII-ZB5XA3GD0I; 1-Phenyl-1,2-propanedione, 99%; Methyl phenyl glyoxal; FEMA 3226; FT-0608215; P0210; 1-phenyl-1,2-dioxopropane; CHEBI:63552; AC1L1X71; MCULE-5571144917; C17268; AJ-29774; SBB064017; Acetyl benzoyl; alpha-keto-propiophenone; AK116651; 1-phenyl-1,2-propane dione; Benzoylacetyl; A831668; ANW-32826; InChI=1/C9H8O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6H,1H;1-phenyl-1,2-propanedione;benzoylacetyl;Pyruvophenone |
C9H8O2 |
148.16 g/mol |
CC(=O)C(=O)C1=CC=CC=C1 |
|
TCMBANKIN058922 |
2,4-dihydroxy acetophenone;WLN: QR CQ DV1 |
W-100356; NSC10883; Resorcinol, 4-acetyl-; KB-17586; AC1Q5ED3; AC1L1NR7; TC-067541; ACMC-209r36; NSC-10883; 2',4'-Dihydroxyacetophenone, 99%; 2,4,-dihydroxyacetophenone; AKOS 90593; 2',4'-DIHYDROXYACETOPHENONE; 1-(2,4-Dihydroxyphenyl)ethanone, 9CI; ST053782; SCHEMBL26357; 4-Acetylresorcinol; beta-Resacetophenone; 2,4-Dihydroxyacetophenone; SULYEHHGGXARJS-UHFFFAOYSA-N; NSC 10883; AN-15263; FS-3456; 1-Acetyl-2,4-dihydroxybenzene; ZB001051; 1-(2,4-Dihydroxyphenyl)ethanone; 2,4-dihydroxyacetophenone; 1,3-Dihydroxy-4-acetylbenzene; .beta.-Resacetophenone; Acetophenone, 2',4'-dihydroxy-; BC676988; BG00600671; AS01140; BIDD:ER0659; AB1002103; SC-07232; MFCD00002279; 4-Acetyl-1,3-benzenediol; NSC-37559; 2,4-Dihydroxy Acetophenone; EINECS 201-945-3; KSC448A9T; AC-1105; TRA0025245; DTXSID4058998; 2,4-DIHYDROOXYACETOPHENONE; ANW-39376; FT-0610122; 2'4'-dihydroxyacetophenone; Ethanone, 1-(2,4-dihydroxyphenyl)-; SBB040836; 1-(2,4-dihydroxy-phenyl)-ethanone; ST2414924; 89-84-9; STK084318; Resoacetophenone; RTC-067541; UC3V356VZC; F1995-0239; 4CN-0699; Resacetophenone; 2,4-dihydroxy actophenone; PubChem3375; 2',4'-Dihydroxyacetophenon; D0561; BBL012128; WLN: QR CQ DV1; 1-Acetyl-2,4-dihydroxybenzene; 4-Acetylresorcinol; Resacetophenone; BRN 1282505; BB_SC-6691; 2,4-dihyroxyacetophenone; MolPort-000-482-777; AKOS BBS-00004294; I01-2131; AC1Q1JHT; AK-50224; ZINC38028; C03663; InChI=1/C8H8O3/c1-5(9)7-3-2-6(10)4-8(7)11/h2-4,10-11H,1H; 1-(2,4-dihydroxyphenyl)ethan-1-one; CS-W008599; TL8005791; BDBM50241221; RL05645; BG01499417; UKRORGSYN-BB BBR-007146; TIMTEC-BB SBB040836; STR03384; 4-Acetyl-Resorcinol; dihydroxyacetophenon; S-1332; KS-00000C03; CHEMBL243374; AM20041337; CJ-00226; 1-Acetylbenzene-2,4-diol; 2',4'-Dihydroxy-acetophenone; 2'',4''-dihydroxyacetophenone; UNII-UC3V356VZC; CHEBI:18414; NSC37559; 1-(2,4-Dihydroxyphenyl)-ethanone; MCULE-8687773185; AI3-00866; CTK3E8099; LS-13469; Z57101026; 4-08-00-01792 (Beilstein Handbook Reference); AJ-08777; AB0000224; AKOS000119522;.beta.-Resacetophenone; Acetophenone, 2',4'-dihydroxy-; NSC10883; 89-84-9; Resoacetophenone; AIDS-017971; Resorcinol, 4-acetyl-; 37450_FLUKA; Resacetophenone; ZINC00038028; EINECS 201-945-3; 2',4'-Dihydroxyacetophenone; D107409_ALDRICH; ST053782; 2′,4′-Dihydroxyacetophenone; BRN 1282505; 4-Acetylresorcinol; 2,4-Dihydroxyacetophenone; NSC 10883; NSC37559; CHEBI:18414; AI3-00866; C03663; AIDS017971; InChI=1/C8H8O3/c1-5(9)7-3-2-6(10)4-8(7)11/h2-4,10-11H,1H; 4-08-00-01792 (Beilstein Handbook Reference); 1-Acetyl-2,4-dihydroxybenzene; Ethanone, 1-(2,4-dihydroxyphenyl)-; 1-(2,4-Dihydroxyphenyl)ethanone |
C8H8O3 |
152.15 |
CC(=O)C1=C(C=C(C=C1)O)O |
|
TCMBANKIN058934 |
p-hydroxyacetophenone |
p-hydroxy-acetophenone; 4'-hydroxyacetophenone; 4-hydroxyacetophenone; Piceol; para-hydroxy-acetophenone; 4′ -Hydroxyacetophenone; c0694; Acetophenone,4'-hydroxy-; C10700; (4-Hydroxyphenyl)ethan-1-one; Ethanone,1-(4-hydroxyphenyl)-; Phenol,p-acetyl-; AB-131/40179700; 99-93-4; p-Hydroxyphenyl methyl ketone; Acetophenone,p-hydroxy-; 4-Hydroksyacetofenol [Polish]; NSC 3698; 1-(4-Hydroxyphenyl)ethanone; AI3-12133; Usaf kf-15; NSC3698; EINECS 202-802-8; p-Oxyacetophenone; WLN: QR DV1; 54180_FLUKA; p-Hydroxyacetophenone; InChI=1/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H; 4'-Hydroxyacetophenone; AIDS026793; 1-(4-Hydroxy-phenyl)-ethanone; HYDROXYACETOPHENONE,PARA; 4-Acetylphenol; p-Hydroxacetophenone; ST5213412; Acetophenone,4'-hydroxy- (8CI); 278564_ALDRICH; p-Acetylphenol; AIDS-026793; 4-Hydroxyacetophenone; Methyl-p-hydroxyphenyl ketone; ZINC00330136; Methyl p-hydroxyphenyl ketone; 4-hydroxy-acetophenone |
C8H8O2 |
136.15 g/mol |
CC(=O)C1=CC=C(C=C1)O |
|
TCMBANKIN058935 |
acetanisole |
4-methoxy-acetophenone;Vananote;4-Acetylanisole; Acetanisole; EINECS 202-815-9; FEMA No. 2005; NSC 209523; InChI=1/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H; Methyl 4-methoxyphenyl ketone; NSC209523; Anisyl, p-, methyl ketone; Ethanone, 1-(4-methoxyphenyl)-; Novatone; 117374_ALDRICH; AI3-00227; ZINC00157405; AB-131/40174083; p-Acetylanisole; WLN: 1VR DO1; 4'-Methoxyacetophenone; 4-Methoxyacetofenon [Czech]; Acetophenone, 4'-methoxy-; W200506_ALDRICH; p-Methoxyphenyl methyl ketone; 4-Methoxyphenyl methyl ketone; ST5213402; Methyl p-methoxyphenyl ketone; 4′-Methoxyacetophenone; 100-06-1; Linarodin; 4-Methoxyacetophenone; p-Methoxyacetophenone; 4-Methoxy-acetophenone; 1-(4-Methoxyphenyl)ethanone; 64710_FLUKA; NSC5601 |
C9H10O2 |
150.17 |
CC(=O)C1=CC=C(C=C1)OC |
|
TCMBANKIN058936 |
Hypnon |
1-Phenylethanone; InChI=1/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H; C07113; Acetylbenzene; ZINC00896628; Ethanone, 1-phenyl-; Acetophenon; 00790_FLUKA; Ketone, methyl phenyl; WLN: 1VR; 442438_SUPELCO; Methyl phenyl ketone; Usaf ek-496; 42163_FLUKA; Ketone, methyl phenyl-; Benzoyl methide; AI3-00575; AIDS-017929; W200905_ALDRICH; FEMA Number 2009; RCRA waste number U004; FEMA No. 2009; Phenyl methyl ketone; NSC 7635; RCRA waste no. U004; NSC7635; A10701_ALDRICH; 98-86-2; CCRIS 1341; AC0; Acetophenone; ST5213401; EINECS 202-708-7; CHEBI:27632; Hypnone; 1-phenylethan-1-one; HSDB 969; Benzoylmethide; 1-Phenyl-1-ethanone; Benzene, acetyl-; c0117; AIDS017929; Acetofenon [Czech]; Acetylbenzol;1-(Phenyl-D5)-Ethanon; NSC 98542-d5; 1-[(2,3,4,5,6-(2)H?)PHENYL]ETHANONE; Acetophenone-(phenyl-d5), 99 atom % D; ACM28077647; DTXSID70466417; Acetophenone-2',3',4',5',6'-d5; Acetophenon-d5; pentadeuterophenyl methyl ketone; FT-0661057; Acetylbenzene-d5; Hypnone-d5; MFCD00064446; 1-(Phenyl-d5)ethanone; 1-(2,3,4,5,6-pentadeuteriophenyl)ethanone; Acetophenone-2/',3/',4/',5/',6/'-d5; SCHEMBL1332185; Methyl (Phenyl-d5) Ketone; DE155; J-016964; 28077-64-7; 1-(Phenyl-d5)-1-ethanone; MolPort-003-929-975; NSC 7635-d5; (Phenyl-d5) Methyl Ketone; Acetophenone-(phenyl-d5); Acetophenone-d5; Acetophenone-2 inverted exclamation marka,3 inverted exclamation marka,4 inverted exclamation marka,5 inverted exclamation marka,6 inverted exclamation marka-d5; Hypnon-d5; 1-Feniletanone-d5; Acetophenone-(phenyl-d5) 99 atom % D; 1-Phenylethanone-d5; Acetophenone-2'3'4'5'6-d5;phenyl-ethanone;acetophenone;phenylethanone;1-phenylethanone |
C8H8O |
120.15 g/mol |
CC(=O)C1=CC=CC=C1 |
|
TCMBANKIN058937 |
WLN: QR BV1;1-(2-hydroxyphenyl)ethanone |
EINECS 204-288-0; Methyl 2-hydroxyphenyl ketone; NSC44452; o-Hydroxyphenyl methyl ketone; AI3-12134; AIDS-017966; Acetophenone, o-hydroxy-; 1-(2-Hydroxyphenyl)ethanone; NSC16933; AIDS017966; FEMA No. 3548; 2-Acetylphenol; Usaf ke-20; o-Acetylphenol; NSC9263; ST5213425; 2-Hydroxyphenyl methyl ketone; BRN 0386123; InChI=1/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H; ACETOPHENONE,2-HYDROXY; Acetophenone, 2'-hydroxy-; 2′-Hydroxyacetophenone; o-Hydroxyacetophenone; 54150_FLUKA; 118-93-4; 4-08-00-00320 (Beilstein Handbook Reference); NSC 16933; H18607_ALDRICH; Ethanone, 1-(2-hydroxyphenyl)-; ZINC01699884; 2'-Hydroxyacetophenone; W354805_ALDRICH; Acetophenone, 2'-hydroxy- (8CI) |
C8H8O2 |
136.15 g/mol |
CC(=O)C1=CC=CC=C1O |
|
TCMBANKIN058939 |
2- acetyl furan;2- acetylfurfun;Acetylfuran;2-furyl methyl ketone;1-(2-furanyl)ethanone |
2-acetylfuran;BG01496319; InChI=1/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H; FT-0610977; Acetylfuran; CHEBI:59983; MolPort-000-871-221;Acetylfuran; NSC 49133; NSC49133; Ketone, 2-furyl methyl; A16254_ALDRICH; Furan, 2-acetyl-; 48200_FLUKA; FEMA No. 3163; MFCD00003242; |
C6H6O2 |
110.11 g/mol |
CC(=O)C1=CC=CO1 |
|
TCMBANKIN058954 |
anisolacetone |
1-(p-Methoxyphenyl)-2-propanone (natural); 64861_FLUKA; NSC 22983; 4-08-00-00460 (Beilstein Handbook Reference); 2-Propanone, 1-(4-methoxyphenyl)-; FEMA No. 2674; 122-84-9; Anisyl methyl ketone; p-Methoxybenzyl methyl ketone; InChI=1/C10H12O2/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H; p-Methoxyphenylacetone; ST5406450; 1-(4-Methoxyphenyl)-2-propanone; 1-(p-Anisyl)-2-propanone; 2-Propanone, 1-(p-methoxyphenyl)-; ghl.PD_Mitscher_leg0.658; (p-Methoxyphenyl)-2-propanone; p-Anisylactone; EINECS 204-578-7; AI3-37913; Anisic ketone; 1-(4-methoxyphenyl)propan-2-one; BRN 2044332; 1-(4-methoxyphenyl)acetone; 4'-Methoxyphenyl-2-propanone; p-Acetonylanisole; W267406_ALDRICH; Anisolacetone; anisketone; 199176_ALDRICH; 4-Methoxyphenylacetone; 2-Propanone, (p-methoxyphenyl)-; 1-(p-Methoxyphenyl)-2-propanone; NSC46101; ZINC01848437; NSC22983; 4-Methoxybenzyl methyl ketone; Anisalacetone |
C10H12O2 |
164.2 |
CC(=O)CC1=CC=C(C=C1)OC |
|
TCMBANKIN059070 |
BU3 |
237639_ALDRICH; C03044; ZINC00901616; CHEBI:16982; (2R,3R)-butane-2,3-diol; (2R,3R)-(−)-2,3-Butanediol; NSC15829;2,3-butanediol;(2R,3R)-(-)-2,3-Butanediol, 97%; 32399-EP2301933A1; CHEBI:16982; OWBTYPJTUOEWEK-QWWZWVQMSA-N; 2,3-Butanediol, (R*,R*)-(+-)-; 2,3-Butanediol, (-)-; AKOS015907648; RTR-011239; Levo-2,3-Butanediol; FT-0604653; (R,R)-2,3-butanediol; AC1Q59P8; TR-011239; D-(-)-2,3-Butanediol; NSC15829; (R,R)-(-)-Butane-2,3-diol; L-(-)-2,3-Butanediol; CTK2F5358; OR02B2286A; NSC-15829; C03044; UNII-TMS4MGA0H4 component OWBTYPJTUOEWEK-QWWZWVQMSA-N; KB-03485; 24347-58-8; (2R,3R)-butane-2,3-diol; (2R,3R)-rel-2,3-Butanediol; BU3; AC1L5EEH; UNII-OR02B2286A; AKOS016015450; RP18534; (2R, 3R)-(-)-2,3-butanediol; AK-84477; ST24033981; (2r,3r)-butan-2,3-diol; (2R*,3R*)-2,3-dihydroxybutane; ZINC901616; (R,R)-(-)-2,3-Dihydroxybutane; (2R, 3R)(-)-2,3-butanediol; (-)-(r,r)-2,3-butanediol; (R,R)-(-)-2,3-Butylene Glycol; MolPort-003-927-419; (R,R)-2,3-Butylene glycol; (2R,3R)-(+)-2,3-butanediol; UNII-45427ZB5IJ component OWBTYPJTUOEWEK-QWWZWVQMSA-N; ANW-25408; I14-2853; J-506903; (R,R)-Butane-2,3-diol; (2R,3R)-(-)-2,3-Butanediol; 32399-EP2311827A1; EINECS 246-186-9; BP-30189; J-500969; (2R,3R)-2,3-butanediol; (r,r)-2,3 butanediol; (-)-(2R,3R)-Butanediol; KS-00000V6N; AJ-24368; (-)-2,3-butanediol; UNII-6510BGK6C5 component OWBTYPJTUOEWEK-QWWZWVQMSA-N; 2,3-Butanediol #; AC-26496; 347B588; (R,R)-(-)-2,3-Butanediol; D(-)-2,3-butanediol; A817243; TL8002002; MFCD00064267; 2,3-Butanediol, threo-; 6982-25-8; DB-009316; FT-0696715; 2,3-Butanediol, [R-(R*,R*)]- |
C4H10O2 |
90.12 |
CC(C(C)O)O |
|
TCMBANKIN059089 |
tert-butylbenzene |
t-butyl benzene; F1908-0117; Dimethylethylbenzene; W-100096; (tert-butyl)benzene; FT-0631505; tert.butylbenzene; HSDB 5315; tert-butyl benzene; A845799; WLN: 1X1 & 1 & R; tert-Butylbenzene, analytical standard; tertiary-Butylbenzene; UNII-M1R2NME7S2; Benzene, (1,1-dimethylethyl)-; NSC 6557; EINECS 202-632-4; NCGC00248088-01; tert-Butylbenzene, 99%; STR09192; B0715; NCGC00254436-01; AN-24475; DTXSID3047138; 1,1-Dimethylethyl-benzene; AI3-00118; DB-057706; 25087-41-6; Z1262252911; 2-methyl-2-phenylpropyl; Benzene, t-butyl-; AKOS000120008; AJ-30215; I01-0112; AC1Q1HYI; M1R2NME7S2; DSSTox_CID_27138; NSC-6557; ST2413956; ZINC1693606; S0661; YTZKOQUCBOVLHL-UHFFFAOYSA-N; DSSTox_GSID_47138; 2-phenyl-iso-butane; Benzene, tert-butyl-; SBB040882; LS-29364; TR-030281; benzene,(1,1-dimethylethyl)-; ST50214479; DSSTox_RID_82145; CTK3J0658; (1,1-dimethylethyl)-benzen; L690; T-BUTYLBENZENE; Tox21_300540; RTR-030281; (tert-Butyl)benzen; ACMC-20ajki; InChI=1/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H; CAS-98-06-6; AC1L1OLJ; MolPort-000-872-044; MCULE-8566444437; Phenyltrimethylmethane; Trimethylphenylmethane; K762; (2-methyl-2-propyl)benzene; benzene,1,1-dimethylethyl-; Pseudobutylbenzene; 2-Methyl-2-phenylpropane; Dimethylethylbenzene (VAN); STL264211; TRA0063605; AK116992; CHEMBL1797277; KB-11855; KSC490M5R; UN 2709 (Related); 4-t-butylbenzene; 22904-43-4; 1998/6/6; t-BuPh; 4-tert-butylphenyl; NSC6557; tert.-butylbenzene; tert-Butylbenzene; KS-00000VKW; MFCD00008816; 1,1-Dimethylethylbenzene; RP20161; tert-butyl-benzene; Benzene, (1,1-dimethylethyl)-; Dimethylethylbenzene; NSC 6557; Pseudobutylbenzene; EINECS 202-632-4; 2-Methyl-2-phenylpropane; Dimethylethylbenzene (VAN); Benzene, tert-butyl-; 19640_FLUKA; HSDB 5315; 98-06-6; B90602_ALDRICH; AI3-00118; WLN: 1X1 & 1 & R; NSC6557; InChI=1/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H; tert-Butylbenzene; Phenyltrimethylmethane; 19650_FLUKA; 1,1-Dimethylethylbenzene; Trimethylphenylmethane; tertiary-Butylbenzene; ST5214479; T-BUTYLBENZENE |
C10H14 |
134.22 g/mol |
CC(C)(C)C1=CC=CC=C1 |
|
TCMBANKIN059097 |
1-Hydroxycumene |
alpha,alpha-Dimethylbenzyl alcohol; 2-Phenyl-2-propanol; P30802_ALDRICH; alpha,alpha-Dimethylbenzenemethanol; 617-94-7; .alpha.-Cumyl alcohol; EINECS 210-539-5; alpha,alpha-Dimethylbenzene methanol; 2-Propanol, 2-phenyl-; Phenyldimethylcarbinol; NSC1261; Dimethyl phenyl carbinol; 2-PHENYLISOPROPANOL; Benzyl alcohol, .alpha.,.alpha.-dimethyl-; Dimethylphenylmethanol; BRN 1905012; NSC 1261; NSC212537; Benzenemethanol, .alpha.,.alpha.-dimethyl-; NSC 212537; 4-06-00-03219 (Beilstein Handbook Reference); 2-Phenylpropan-2-ol; HSDB 5718; InChI=1/C9H12O/c1-9(2,10)8-6-4-3-5-7-8/h3-7,10H,1-2H; .alpha.,.alpha.-Dimethylbenzyl alcohol; Benzyl alcohol, alpha,alpha-dimethyl-; Benzenemethanol, alpha,alpha-dimethyl-; alpha-Cumyl alcohol; 78940_FLUKA; Dimethylphenylcarbinol; AI3-05532; ZINC01591819;α,α-dimethylbenzene methanol;2-phenyl-2-propanol;alpha-dimethylbenzene methanol |
C9H12O |
136.19 |
CC(C)(C1=CC=CC=C1)O |
|
TCMBANKIN059181 |
1-methylethylbenzene |
NaPst;Gedex; Benzene, isopropyl; BENZENE,ISOPROPYL CUMOL; 105270-05-1; 686E; 51609-83-7; Esbrite G 10; Estyrene G-P 4; 61584-90-5; NBS 706; Benzene, (1-methylethyl)-; Estyrene H 61; Dow 860; 11120-46-0; AI3-04630; Afcolene; Copal Z; Krasten 052; Piccolastic A 50; Benzene, (1-methylethyl)-, oxidized, polyphenyl residues; 81834-12-0; Bicolene H; LS 1028E; Carinex GP; MX 4500; Dylite F 40L; 52932-49-7; Bio-Beads S-S 2; 12627-11-1; RCRA waste number U055; Esbrite 2; Estyrene G 15; S 173; (1-Methylethyl)benzene; Propane, 2-phenyl-; Diarex HT 88A; A 3-80; Benzene, ethenyl-, homopolymer; Koplen 2; Bustren; Dow 456; Cosden 550; Dow MX 5514; Carinex tgx/MF; R 3612; NCGC00091155-01; Krasten 1.4; Benzene, (1-methylethyl)-, oxidized, sulfurized by-products; Afcolene 666; 2-Fenilpropano [Italian]; Piccolastic C 125; K 525; HF 77; R 3; 51609-87-1; Dow MX 5516; Esbrite 8; Dylene 9; 475U; Piccolastic A; Diarex HT 88; 68333-89-1; 9055-91-8; Edistir RB; N 4000V; 53112-49-5; Piccolastic; 550P (styrene polymer); Isopropilbenzene [Italian]; 61584-89-2; Afcolene 492; Bustren K 500; Isopropylbenzene; HT-F 76; Piccolastic D-100; Dorvon; BASF III; Isopropylbenzeen; Dorvon FR 100; Dylite F 40; 36698_RIEDEL; Foster grant 834; Dow 1683; HF 55; 54596-41-7; Denka QP3; Piccolastic A 5; 28220_FLUKA; Diarex HT 90; 172641-48-4; HT 88; 2-Fenyl-propaan; 117079-77-3; Piccolastic D; Bicolastic A 75; EINECS 269-798-8; FC-MY 5450; Esbrite LBL; Isopropilbenzene; Lustrex HH 101; Estyrene G 20; Polystyrene resin; Lustrex H 77; C87657_ALDRICH; HHI 11; Pelaspan Esp 109s; Atactic polystyrene; Cumeen [Dutch]; 60328-46-3; C14396; 666U; Diarex HF 55; Latex; Isopropylbenzene [UN1918] [Flammable liquid]; Sulfurized by-product of cumene oxidation; Bustren K 525-19; 55128-06-8; Diarex 43G; Bakelite SMD 3500; Benzene, isopropyl-; Isopropylbenzol; InChI=1/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H; MX 5517-02; Piccolastic A 25; FG 834; Lustrex HT 88; 68411-37-0; Hostyren N 4000V; Phenol bottoms; Hostyren S; IT 40; CHEBI:34656; Bextrene XL 750; 28230_FLUKA; 98444-30-5; 168N15; BSB-S 40; HSDB 172; Carinex SB 59; Esbrite 500HM; 56451-72-0; Esbrite; Diarex HT 500; 454H; 120037-99-2; Estyrene 500SH; HF 10; Diarex HT 190; MX 5516; NSC8776; NSC 8776; 86090-91-7; ST5214393; Pelaspan 333; Lacqren 506; Ethenylbenzene homopolymer; 2-Fenilpropano; Piccolastic A 75; 68553-94-6; Krasten SB; Bustren Y 825; 98-82-8; Esbrite 4-62; BDH 29-790; BSB-S-E; MX 5514; Esbrite 4; Cadco 0115; 53986-84-8; KR 2537; HH 102; X 600; Cumeen; Carinex SL 273; Hostyren N 4000; 172867-64-0; WLN: 1Y1 & R; Dow 665; Isopropylbenzen; 57657-06-4; KB (Polymer); KM (Polymer); Hostyren N; Esbrite G-P 2; Lustrex; Estyrene 4-62; Benzene, 1-methylethyl-; RCRA waste no. U055; Isopropyl-benzol; 58033-91-3; Carinex HR; 39470-87-6; 2-Fenyl-propaan [Dutch]; BP-Klp; Adion H; Lacqren 550; 2-Phenylpropane; Dylark 250; EINECS 270-120-8; Styrofoam; Diarex YH 476; Bustren U 825; 825TV; Afcolene S 100; HI-Styrol; 144637-93-4; Cosden 945E; Dylene; HT 91-1; Bactolatex; 56748-62-0; Dylene 8G; 31N (styrene polymer); Dylene 8; Propane, 2-phenyl; Ethenylbenzene, homopolymer; Isopropylbenzeen [Dutch]; A 75 (vinyl polymer); Styrene polymer; A 180 (vinyl polymer); 60120-16-3; UN1918; CUMENE; (propan-2-yl)benzene; Bustren Y 3532; Lustrex HP 77; Dow 360; 63849-49-0; Polyphenyl residue; Isopropyl-benzol [German]; Carinex SB 61; Hostyren N 7001; Bustren U 825E11; EINECS 202-704-5; LS 061A; Diarex HF 55-247; Escorez 7404; Cumol; 60880-98-0; 40494-15-3; Diarex HS 77; 9044-64-8; U625; Carinex HRM; Owispol GF; HT 88A; 55465-00-4;cumene |
C9H12 |
120.19 g/mol |
CC(C)C1=CC=CC=C1 |
|
TCMBANKIN059340 |
5β-cholanicacid |
5 beta-cholanic acid; Cholanoic acid; 5.beta.-Cholanic acid; CHEBI:36238; Cholan-24-oic acid, (5beta)- (9CI); LMST04010441; Cholan-24-oic acid, (5.beta.)-; (4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid; NSC18161; (4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid; Ursocholanic acid; 5beta-Cholanoic acid; 5beta-Cholan-24-oic acid (8CI); NSC 18161; Androstane-17-butanoic acid, gamma-methyl-, (5beta,17beta)-; 5beta-Cholan-24-oic Acid; 5.beta.-Cholan-24-oic acid; L 596205-0; 5beta-Cholanic acid; Androstane-17-butanoic acid, .gamma.-methyl-, (5.beta.,17.beta.)-; (5beta)-cholan-24-oic acid; 546-18-9; 5.beta.-Cholanoic acid; (5beta,17beta)-gamma-methylandrostane-17-butanoic acid |
C24H40O2 |
360.57 |
CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C |
|
TCMBANKIN059367 |
1,2-propanediol |
aliphatic alcohol; Centella sugar; PGR; (S)-(+)- 1,2-propanediol; 4254-14-2; ZINC00895318; (R)-Propylene glycol; 82284_FLUKA; CHEBI:28972; C02912; R-1,2-PROPANEDIOL; 2,3-PROPANDIOL; (R)-(−)-1,2-Propanediol; HP3; (R)-(−)-Propylene glycerol; (R)-(−)-Propylene glycol; 540242_ALDRICH; (R)-Propane-1,2-diol; NSC90793; (2R)-propane-1,2-diol; (R)-1,2-Propanediol |
C3H8O2 or CH3CHOHCH2OH |
76.09 g/mol |
CC(CO)O |
|
TCMBANKIN059438 |
2-methoxy-4-propenyl phenol |
|
C10H12O2 |
164.2 g/mol |
CC=CC1=CC(=C(C=C1)O)OC |
|
TCMBANKIN059443 |
isoallylbenzene |
|
C9H10 |
118.18 g/mol |
CC=CC1=CC=CC=C1 |
|
TCMBANKIN059521 |
B- pinene;pinene;T-pinene;(-)-nopinene;beta-pinene;bicyclo[3.1.1]heptane,6,6-dimethyl-2-methylene-,(1s);1-β-pinene;()-beta-Pinene;(-)- β- pinene;laevo- β- Pinene |
|
C10H16 |
136.23 g/mol |
CC1(C2CCC(=C)C1C2)C |
|
TCMBANKIN059522 |
(1R)-()-Nopinone |
|
C9H14O |
138.21 g/mol |
CC1(C2CCC(=O)C1C2)C |
|
TCMBANKIN059677 |
1,2,3,4-tetramethylbenzene |
|
C10H14 |
134.22 g/mol |
CC1=C(C(=C(C=C1)C)C)C |
|
TCMBANKIN059686 |
2,3-Dimethylphenol |
|
C8H10O |
122.16 |
CC1=C(C(=CC=C1)O)C |
|
TCMBANKIN059728 |
3,4-dimethyl-styrene |
|
C10H12 |
132.2 g/mol |
CC1=C(C=C(C=C1)C=C)C |
|
TCMBANKIN059736 |
pyrolin |
|
C7H8O2 |
124.14 g/mol |
CC1=C(C=CC(=C1)O)O |
|
TCMBANKIN059834 |
1,4-Benzenediol,2,3,5-trimethyl- |
|
C9H12O2 |
152.19 g/mol |
CC1=CC(=C(C(=C1O)C)C)O |
|
TCMBANKIN059836 |
thymol |
|
C10H14O |
150.22 |
CC1=CC(=C(C=C1)C(C)C)O |
|
TCMBANKIN059839 |
Psi-cumene |
|
C9H12 |
120.19 g/mol |
CC1=CC(=C(C=C1)C)C |
|
TCMBANKIN059840 |
2,5-dimethylbenzaldehyde |
|
C9H10O |
134.18 |
CC1=CC(=C(C=C1)C)C=O |
|
TCMBANKIN059842 |
o-Acetyl-p-cresol |
|
C9H10O2 |
150.17 g/mol |
CC1=CC(=C(C=C1)O)C(=O)C |
|
TCMBANKIN059843 |
4-methyl-2-methoxyphenol |
|
C8H10O2 |
138.16 g/mol |
CC1=CC(=C(C=C1)O)OC |
|
TCMBANKIN059853 |
Fleet-X |
|
C9H12 |
120.19 |
CC1=CC(=CC(=C1)C)C |
|
TCMBANKIN059860 |
m-xylene |
|
C8H10 |
106.17 g/mol |
CC1=CC(=CC=C1)C |
|
TCMBANKIN059901 |
p-xylene |
|
C8H10 |
106.17 |
CC1=CC=C(C=C1)C |
|
TCMBANKIN059903 |
WLN: QVR D1 |
|
C8H8O2 |
136.15 g/mol |
CC1=CC=C(C=C1)C(=O)O |
|
TCMBANKIN059908 |
xylene |
|
C8H10 |
106.17 |
CC1=CC=C(C=C1)C.CC1=CC(=CC=C1)C.CC1=CC=CC=C1C |
|
TCMBANKIN059917 |
methylbenzol |
|
C6H5CH3 |
92.14 g/mol |
CC1=CC=CC=C1 |
|
TCMBANKIN059920 |
o-methylacetophenone |
|
C9H10O |
134.17 g/mol |
CC1=CC=CC=C1C(=O)C |
|
TCMBANKIN059921 |
o- Cymene |
|
C10H14 |
134.22 g/mol |
CC1=CC=CC=C1C(C)C |
|
TCMBANKIN059922 |
o-cresol;Phenol, 2- methyl-;2-hydroxytoluene |
|
C7H8O |
108.14 g/mol |
CC1=CC=CC=C1O |
|
TCMBANKIN059923 |
2-methylpyridine |
|
C6H7N |
93.13 g/mol |
CC1=CC=CC=N1 |
|
TCMBANKIN059924 |
Methyl naphthalene |
|
C11H10 |
142.2 g/mol |
CC1=CC=CC2=CC=CC=C12 |
|
TCMBANKIN059973 |
WLN: T5OV CHJ E1 |
|
C5H6O2 |
98.1 |
CC1=CCC(=O)O1 |
|
TCMBANKIN060040 |
2,3,5-trimethyl-pyrazine;TRIMETHYLPYRAZINE |
|
C7H10N2 |
122.17 |
CC1=CN=C(C(=N1)C)C |
|
TCMBANKIN060045 |
Skatol |
|
C9H9N |
131.17 |
CC1=CNC2=CC=CC=C12 |
|
TCMBANKIN060593 |
()-Aromadendrene;(+)-aromadendrene |
|
C15H24 |
204.35 |
CC1CCC2C1C3C(C3(C)C)CCC2=C |
|
TCMBANKIN060599 |
Methylcyclopentane |
|
C30H54S2;C6H12 |
478.88;84.16 |
CC1CCCC1 |
|
TCMBANKIN060607 |
methylcyclohexane |
|
C7H14 |
98.19 g/mol |
CC1CCCCC1 |
|
TCMBANKIN060608 |
cis-Hexahydro-o-xylene |
|
C8H16 |
112.21 g/mol |
CC1CCCCC1C |
|
TCMBANKIN060624 |
2-butanal |
|
C4H8O |
72.11 g/mol |
CCC(=O)C |
|
TCMBANKIN060693 |
Sitogluside |
|
C35H60O6 |
576.85g/mol |
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C |
|
TCMBANKIN060731 |
4-ethylguaiacol |
|
C9H12O2 |
152.19 g/mol |
CCC1=CC(=C(C=C1)O)OC |
|
TCMBANKIN060732 |
1-methyl-4-ethylbenzene |
|
C9H12 |
120.19 g/mol |
CCC1=CC=C(C=C1)C |
|
TCMBANKIN060734 |
3-Ethyltoluene |
|
C9H12 |
120.19 g/mol |
CCC1=CC=CC(=C1)C |
|
TCMBANKIN060735 |
EB |
|
C8H10 |
106.16 g/mol |
CCC1=CC=CC=C1 |
|
TCMBANKIN060736 |
Phlorol |
|
C8H10O |
122.16 |
CCC1=CC=CC=C1O |
|
TCMBANKIN060737 |
2-ethylfuran |
|
C6H8O |
96.13 g/mol |
CCC1=CC=CO1 |
|
TCMBANKIN060739 |
1-ethyl-cyclohexene |
|
C8H14 |
110.2 g/mol |
CCC1=CCCCC1 |
|
TCMBANKIN060796 |
Cerulignol |
|
C10H14O2 |
166.22g/mol |
CCCC1=CC(=C(C=C1)O)OC |
|
TCMBANKIN060800 |
propyl cyclopentane |
|
C8H16 |
112.21 |
CCCC1CCCC1 |
|
TCMBANKIN060879 |
Linolic acid |
|
C18H32O2 |
280.4 g/mol |
CCCCCC=CCC=CCCCCCCCC(=O)O |
|
TCMBANKIN060958 |
oleic acid;cis-oleic acid;oleinic acid |
|
C18H34O2 |
282.46 |
CCCCCCCCC=CCCCCCCCC(=O)O |
|
TCMBANKIN061221 |
n-propanol |
|
C3H8O |
60.1 g/mol |
CCCO |
|
TCMBANKIN061273 |
1-ethoxy-4-methylbenzene |
|
C9H12O |
136.19 g/mol |
CCOC1=CC=C(C=C1)C |
|
TCMBANKIN061283 |
trimethylamine |
|
C3H9N |
59.11 g/mol |
CN(C)C |
|
TCMBANKIN061379 |
n-methylanthranilic acid |
WLN: QVR BM1; KBioSS_000660; AP-065/40180106; N-Methyl-2-aminobenzoic acid; 730910-17-5; Anthranilic acid, N-methyl-; Kyselina N-methylanthranilova [Czech]; Spectrum5_000453; o-(Methylamino)benzoic acid; SpecPlus_000945; KBio2_000660; BSPBio_002365; SBB006591; NCGC00095760-01; 4-14-00-01015 (Beilstein Handbook Reference); KBioGR_002073; Kyselina N-methylanthranilova; Kyselina 2-methylaminobenzoova [Czech]; N-Methylanthranilic acid; Spectrum3_000673; AI3-05924; 137065_ALDRICH; KBio2_005796; Spectrum2_001916; CHEBI:16394; DivK1c_007041; EINECS 204-343-9; Spectrum4_001637; NSC3782; N-Methyl-o-aminobenzoic acid; SPECTRUM1600964; KBio2_003228; Oprea1_531375; 119-68-6; 2-(Methylamino)benzoic acid; KBio3_001585; BRN 2208135; SPBio_001912; C03005; 2-methylaminobenzoic acid; NSC 3782; Spectrum_000180; KBio1_001985; Benzoic acid, 2-(methylamino)-; SDCCGMLS-0066851.P001 |
C8H9NO2 |
151.16 g/mol |
CNC1=CC=CC=C1C(=O)O |
|
TCMBANKIN061396 |
Methyl (Z)-cinnamate |
Methyl cinnamate, (Z); (Z)-3-phenylacrylic acid methyl ester; methyl (Z)-3-phenylprop-2-enoate; (Z)-3-phenylprop-2-enoic acid methyl ester |
C10H10O2 |
162.19 |
COC(=O)C=CC1=CC=CC=C1 |
|
TCMBANKIN061403 |
Abiol |
AIDS209944; Methyl Parasept; H3647_SIGMA; Methyl p-hydroxybenzoate; BRN 0509801; FEMA Number 2710; p-Methoxycarbonylphenol; 4-HYDROXY-BENZOIC ACID METHYL ESTER; Benzoic acid, p-hydroxy-, methyl ester; Nipagin M; 4-Hydroxybenzoic acid, methyl ester; Nipagin; p-Oxybenzoesauremethylester [German]; D01400; Methyl chemosept; p-Hydroxybenzoic methyl ester; 4-(Methoxycarbonyl)phenol; Tegosept M; 4-10-00-00360 (Beilstein Handbook Reference); Aseptoform; H6654_SIAL; Methyl 4-hydroxybenzoate; Maseptol; BENZOIC ACID,4-HYDROXY,METHYL ESTER; AI3-01336; NCGC00159376-02; Methylparaben (TN); Metaben; Methyl-p-hydroxybenzoate; 99-76-3; Preserval M; Methylparaben (NF); Methyl parahydroxybenzoate (JP15); ST5214511; p-Hydroxybenzoic acid methyl ester; CCRIS 3946; Methyl ester of p-hydroxybenzoic acid; Methylparaben; p-Hydroxybenzoic acid, methyl ester; Caswell No. 573PP; FEMA No. 2710; NCGC00159376-03; p-Carbomethoxyphenol; Methylben; 47889_SUPELCO; NSC3827; ZINC00001712; AIDS-209944; Preserval; HSDB 1184; Metoxyde; Methaben; Moldex; WLN: QR DVO1; 4-Hydroxybenzoic acid methyl ester; InChI=1/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H; Solbrol M; Methylparaben [USAN]; 54752_FLUKA; Benzoic acid, 4-hydroxy-, methyl ester; Methyl parahydroxybenzoate; component of Heb-Cort MC; 54750_FLUKA; NSC406127; Methyl Butex; Solbrol; Methyl paraben; Paridol; EINECS 202-785-7; M8911_SIAL; Methyl p-oxybenzoate; NSC 3827; W271004_ALDRICH; EPA Pesticide Chemical Code 061201; Methyl parahydroxybenzoate (TN); Methylester kyseliny p-hydroxybenzoove [Czech]; Septos; methyl p-hydroxybenzoate; 4-hydroxybenzoic acid methyl ester; methyl-4-hydroxybenzoate; Methyl paraben; methylparaben |
C8H8O3 |
152.15 g/mol |
COC(=O)C1=CC=C(C=C1)O |
|
TCMBANKIN061404 |
Clorius |
AI3-00525; NSC 9394; InChI=1/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H; 18344_FLUKA; benzoic acid methyl ester; AIDS-018029; Oil of Niobe; UN2938; ZINC00156868; AIDS018029; Methyl benzoate; CCRIS 5851; EINECS 202-259-7; Methyl benzoate [UN2938] [Keep away from food]; Essence of niobe; WLN: 1OVR; Clorius (VAN); Methylester kyseliny benzoove [Czech]; oniobe oil; 93-58-3; W268305_ALDRICH; FEMA No. 2683; Methyl benzenecarboxylate; 27614_RIEDEL; Benzoic acid, methyl ester; Methyl benzoate (natural); oxidate le; Methylbenzoate; NSC9394; Niobe oil; M29908_ALDRICH; W268313_ALDRICH; HSDB 5283; NCGC00091665-01;I01-2293; AC1L1O4G; MFCD00008421; Z19825577; benzoic acid methylester; Oxidate le; EC 202-259-7; NCGC00259381-01; UN2938; benzoic acid methyl; 102027-EP2371831A1; NCGC00256939-01; A844641; EINECS 202-259-7; NSC-9394; C20645; KSC487A6F; WLN: 1OVR; DSSTox_GSID_25572; Methyl benzenecarboxylate; Benzoic acid, methyl ester; Methyl benzoate, for synthesis, 98.0%; Methyl benzoate (natural); BB_SC-7167; UNII-6618K1VJ9T; AKOS000120640; Methylbenzoate; AN-42658; MCULE-3681534655; Methyl benzoate, analytical standard; AI3-00525; InChI=1/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H; TC-060464; DSSTox_RID_77836; ANW-75136; ZINC156868; SMR001216584; 102027-EP2272817A1; Methyl ester of benzoic acid; UN 2938; (benzoyloxy)methyl; Methylester kyseliny benzoove; 93-58-3; 102027-EP2301983A1; CHEMBL16435; KB-54731; SC-18079; J-522592; F0001-2239; 1082718-77-1; Niobe oil; NCGC00091665-01; CTK3I7062; NSC 9394; ST51015549; ACT10969; Methyl benzoate, 99%; CAS-93-58-3; BBL010502; CCRIS 5851; DSSTox_CID_5572; Methyl benzoate [UN2938] [Keep away from food]; 102027-EP2287940A1; Methyl benzoate [UN2938] [Keep away from food]; B0074; SCHEMBL7200; Essence of niobe; FEMA No. 2683; FT-0622713; Methyl benzoate, natural, >=98%, FCC, FG; STK021498; SBB058212; Tox21_303198; MLS001050185; SCHEMBL4790973; Tox21_201832; DTXSID5025572; Methyl benzoate, >=99% (GC); RP20261; 6618K1VJ9T; Methyl benzoate, >=98%, FCC, FG; AK-98161; benzoic acid methyl ester; METHYL BENZOATE; KS-00000VMQ; CHEBI:72775; methyloxycarbonylbenzene; AJ-13898; SCHEMBL10330498; ST24031184; 102027-EP2289965A1; Clorius; TRA0079771; Methylester kyseliny benzoove [Czech]; RTC-060464; Oil of niobe; ZB006457; ACMC-20aioi; NCGC00091665-02; LS-1945; MolPort-001-783-861; Oniobe oil; 102027-EP2275469A1; NSC9394; QPJVMBTYPHYUOC-UHFFFAOYSA-N; HSDB 5283 |
C8H8O2 |
136.15 |
COC(=O)C1=CC=CC=C1 |
|
TCMBANKIN061407 |
methyl salicylate |
NCGC00091106-02; Birch oil, sweet; Methyl salicylate (JP15/NF); Methylester kyseliny salicylove [Czech]; Gaultheriaoel; Spicewood Oil; Birch oil; InChI=1/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H; Betula Lenta; 4-10-00-00143 (Beilstein Handbook Reference); FEMA Number 2745; Theragesic; EPA Pesticide Chemical Code 076601; Panalgesic; 2-Hydroxybenzoic acid, methyl ester; 76631_FLUKA; 119-36-8; o-Hydroxybenzoic acid, methyl ester; 2-Carbomethoxyphenol; Teaberry oil; Metylester kyseliny salicylove [Czech]; M2047_SIAL; Methyl salicylate (natural); 84332_FLUKA; Analgit; Flucarmit; Methyl o-hydroxybenzoate; Sweet birch oil; Methyl salicylate (TN); Methyl salicylate [JAN]; Gaultheria oil; Wintergruenoel; Enamine_001611; Oil of Wintergreen; M6752_SIAL; Synthetic Wintergreen Oil; 8022-86-4; Betula oil; Gaultheria Oil, artificial; Betula; Wintergreen oil; Metylester kyseliny salicylove; 2-Hydroxybenzoic acid methyl ester; Exagien; EINECS 204-317-7; FEMA No. 2745; 2-(Methoxycarbonyl)phenol; WLN: QR BVO1; W215481_ALDRICH; LS-616; Caswell No. 577; AI3-00090; W274518_ALDRICH; NSC8204; Methyl 2-hydroxybenzoate; W311308_ALDRICH; Natural Wintergreen Oil; C12305; ZINC00000490; HSDB 1935; T0505-2596; Benzoic acid, 2-hydroxy-, methyl ester; Methyl salicylate; D01087; 8024-54-2; BRN 0971516; NSC 8204; NCGC00091106-01; Wintergreen Oil, synthetic; CCRIS 6259; Salicylic acid, methyl ester; Methyl hydroxybenzoate; salicylic acid,methyl ester; Gaultheriaoel |
C8H8O3 |
152.15 g/mol |
COC(=O)C1=CC=CC=C1O |
|
TCMBANKIN061421 |
benzeneaceticacid,methylester |
Methyl phenylacetate;I14-7331; Methyl .alpha.-toluate; methy phenylacetate; Tox21_300792; EC 202-940-9; ANW-14465; EBD50083; ACMC-2097v7; BB_SC-7169; CAS-101-41-7; KB-54814; CHEMBL3189123; 101-41-7; CS-W018528; RTR-000377; MCULE-9593207528; D4PDC41X96; ZINC00388061; FT-0653159; SCHEMBL4675; AK163377; CJ-03094; alpha-phenylacetic acid methyl ester; KSC175C1T; NCGC00248170-01; SC-26761; Phenylacetic acid methyl; Methyl alpha-toluate; Phenylacetic acid methyl ester; benzene acetic acid methyl ester; FEMA 2733; TR-000377; Mephaneine; MolPort-001-788-281; STL146152; Acetic acid, phenyl-, methyl ester; AKOS000119976; BBL010506; DSSTox_CID_24352; Methyl phenylacetate, >=98%, FCC, FG; Methyl benzeneethanoate; METHYL PHENYLACETATE; InChI=1/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H; KS-00000GN1; AC1Q5ZUJ; 2-Phenylacetic acid methyl ester; Methyl 2-phenyl acetate; ZINC388061; EINECS 202-940-9; SBB058223; Methyl phenylacetate, ReagentPlus(R), >=99%; DSSTox_GSID_44352; MFCD00008453; ZB011258; Methyl benzene acetate; Methyl phenylethanoate; Methyl phenylacetate, Vetec(TM) reagent grade, 98%; NSC-9405; 78540_FLUKA; UNII-D4PDC41X96; LS-2954; NSC 401667; Methyl benzeneacetate; NSC-401667; FEMA No. 2733; AN-24576; TRA-0184135; NSC401667; CRZQGDNQQAALAY-UHFFFAOYSA-N; DTXSID1044352; Phenylacetic acid, methyl ester; DSSTox_RID_80161; P0125; methyl 2-phenylethanoate; RP17360; AB1011175; Methyl ester of Phenylacetic acid; methyl phenyl acetate; 108057_ALDRICH; WLN: 1OV1R; AC1L1P1D; Benzeneacetic acid, methyl ester; METHYLPHENYLACETATE; CTK0H5119; Methyl phenylacetate, analytical standard; ST50824226; Phenyl-acetic acid methyl ester; Methyl 2-phenylacetate; NCGC00254696-01; ST24047740; Methyl alpha-toluate; methyl phenylacetate; NSC9405; AI3-01971; 2-phenylacetic acid methyl ester; W273309_ALDRICH; Phenylacetic Acid Methyl Ester |
C9H10O2 |
150.17 g/mol |
COC(=O)CC1=CC=CC=C1 |
|
TCMBANKIN061458 |
2,6-dimethoxyphenol |
2,6-dimethoxy-phenol;Aldrich;FEMA No. 3137; ZINC00154666; 1,3-Di-o-methylpyrogallol; 38772_FLUKA; 1,3-Dimethoxy-2-hydroxybenzene; 2,6-Dwumetoksyfenol [Polish]; Phenol, 2,6-dimethoxy-; C10787; D135550_ALDRICH; W313726_ALDRICH; CHEBI:955; Pyrogallol 1,3-dimethyl ether; Syringol; EINECS 202-041-1; 91-10-1; W313718_ALDRICH; Pyrogallol dimethylether; 2-Hydroxy-1,3-dimethoxybenzene; 2,6-Dimethoxyphenol; 1,3-Dimethyl pyrogallate |
C8H10O3 |
154.16 g/mol |
COC1=C(C(=CC=C1)OC)O |
|
TCMBANKIN061466 |
Isovanillic acid |
BRN 2208365; Benzoic acid, 3-hydroxy-4-methoxy-; ST5406548; InChI=1/C8H8O4/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,9H,1H3,(H,10,11; 3-Hydroxyanisic acid; 220108_ALDRICH; Acide isovanillique; 3-HYDROXY-4-METHOXYBENZOIC ACID; isovanillic acid; EINECS 211-430-5; p-Anisic acid, 3-hydroxy-; 3-Hydroxy-p-anisic acid; 3-hydroxy-4-methoxy-benzoic acid;3-hydroxy-4-methoxy benzoicacid;3-Hydroxy-4-methoxybenzoic acid; 3- hydroxy- 4- methoxy- benzoic acid |
C8H8O4 |
168.15 g/mol |
COC1=C(C=C(C=C1)C(=O)O)O |
|
TCMBANKIN061473 |
Isovanillin |
3-Hydroxy-4-anisaldehyde; 3-Hydroxy-4-methoxybenzaldehyde; FT-0615821; ANW-34085; 4-Methoxy-3-hydroxy-benzaldehyde; DSSTox_RID_83498; ACMC-209n07; 4-methoxy-5-hydroxybenzaldehyde; NCGC00247609-01; BR-26987; SMR000156287; 143685_ALDRICH; BG01499429; CHEMBL275563; AK-26987; SBB008245; SC-05820; Q-100718; 3-Hydroxy-4-methoxybenzaldehyde; 3-hydroxy-4-anisaldehyde; MCULE-7646011311; 621-59-0; PubChem7770; F1995-0251; RTC-060637; 3-hydroxy-4-methoxy- benzaldehyde; 3-hydroxy-4-methoxy- benzaldehyde;BB_NC-2245; 3-Hydroxyanisaldehyde; AJ-16240; DSSTox_GSID_49423; 4A9N90H9X6; PS-4589; Isovanilline; 3-Hydroxy-para-anisaldehyde; MolPort-000-146-016; 3-hydroxy-4methoxy-benzaldehyde; NSC82996; SCHEMBL70256; BC204204; JVTZFYYHCGSXJV-UHFFFAOYSA-N; Tox21_202858; 4-Methoxy-3-hydroxybenzaldehyde; KS-000002MN; DTXSID7049423; 3-hydroxy-4-methoxy benzaldehyde; p-Anisaldehyde, 3-hydroxy- (8CI); Benzaldehyde, 3-hydroxy-4-methoxy-; AN-15747; D0E9CD; EBD684885; isovanillin; I0519; LS10550; A833619; 59927_FLUKA; HMS3348H19; Isovanicaline; 4-methoxy-3-oxidanyl-benzaldehyde; 3-Hydroxy-4-methoxy-benzaldehyde; LS-25072; 4-08-00-01764 (Beilstein Handbook Reference); HMS2194I16; AC-541; KSC354M3B; ZINC164617; Isovanillin, >=95.0%; ISOVANILLIN; ST50213460; I01-0153; BBL023550; NCGC00260404-01; BG00600677; NSC 82996; WLN: VHR CQ DO1; isovanilin; BRN 1073021; NSC-82996; 3-hydroxy-4-methoxy-benzaldehyde; CJ-02189; ZB008229; MLS000574853; Oxy-3 methoxy-4 benzaldehyde; DSSTox_CID_29383; CS-W009023; NCIOpen2_001085; 3-Hydroxy-4-methoxybenzaldehyde, 99%; DB-010058; 3-Hydroxyanisaldehyde; Isovanillin; 59940_FLUKA; ST24022906; AC1Q469E; STK400134; TRA0093875; InChI=1/C8H8O3/c1-11-8-3-2-6(5-9)4-7(8)10/h2-5,10H,1H; AKOS000120260; 3-hydroxy4-methoxybenzaldehyde; M-6105; CAS-621-59-0; TC-060637; TL8004050; AB1002458; CM13992; Oxy-3 methoxy-4 benzaldehyde [French]; p-Anisaldehyde, 3-hydroxy-; CTK2F4630; iso-Vanillin; AC1L1YWO; 5-Formylguaiacol; FT-0615853; 21I590; isovaniline; ZINC00164617; RP21587; KB-32136; BDBM50240367; 3-Hydroxy-p-anisaldehyde; P-Anisaldehyde, 3-hydroxy-(8CI); UNII-4A9N90H9X6; EINECS 210-694-9; MFCD00003369 |
C8H8O3 |
152.15 |
COC1=C(C=C(C=C1)C=O)O |
|
TCMBANKIN061568 |
EUG |
4-vinyl-2-methoxy-phenol;2- methoxy—vinylphenol;2-Methoxy-4-vinylphenol;2-methoxy-4-vinylphenol;4-Hydroxy-3-methoxyvinylbenzene; 4-vinylguaiacol; 7786-61-0; FEMA No. 2675; EINECS 232-101-2; p-Vinyl guaiacol; Phenol, 4-ethenyl-2-methoxy-; W267511_ALDRICH; p-Vinylguaiacol; CPD-1072; ZINC01849800; 4-ethenyl-2-methoxy-phenol; 3-06-00-04981 (Beilstein Handbook Reference); 2-METHOXY-4-VINYL-PHENOL; BRN 2044521; LS-2530; 4-Hydroxy-3-methoxystyrene; 31853-85-7; Phenol, 2-methoxy-4-vinyl-; Vinylcatechol-O-methyl ether, P-; 2-Methoxy-4-vinylphenol; CCRIS 548; Guaiacol, 4-vinyl-; 4-ETHENYL-2-METHOXYPHENOL |
C9H10O2 |
150.17 |
COC1=C(C=CC(=C1)C=C)O |
|
TCMBANKIN061642 |
2-MOHYDROP |
2-methoxybenzene-1,4-diol; AIDS-220863; AIDS-220870; 2-Methoxyhydroquinone polymer; 176893_ALDRICH; 2,5-Dihydroxyanisol; 64992_FLUKA; ZINC00164619; 1,4-Benzenediol, 2-methoxy-; AIDS220870; AIDS220863; InChI=1/C7H8O3/c1-10-7-4-5(8)2-3-6(7)9/h2-4,8-9H,1H; 824-46-4; EINECS 212-530-1; 2-Methoxyhydroquinone; o-Methoxyhydroquinone |
C7H8O3 |
140.14 |
COC1=C(C=CC(=C1)O)O |
|
TCMBANKIN061812 |
ANN |
CHEBI:40813; Anisic acid, p-isomer; ANISIC ACID, PARA; 4-10-00-00346 (Beilstein Handbook Reference); EINECS 202-818-5; C02519; 10550_FLUKA; p-Anisic acid; 4-Methoxybenzoic acid; p-Methoxybenzoic acid; ST5213868; 4-Anisic acid; NCIOpen2_004706; W394505_ALDRICH; NSC32742; 84688_FLUKA; AIDS018080; 117390_ALDRICH; Benzoic acid, 4-methoxy-; 100-09-4; InChI=1/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10; AI3-00893; AE-848/32075009; AIDS-018080; NSC7926; Draconic acid; EINECS 215-618-8; BRN 0508910; 1335-08-6; Kyselina 4-methoxybenzoova [Czech]; NSC 32742; ANISIC ACID;p-anisic acid;anisicacid;4-methoxy benzoic acid;4-anisate; 4-Methoxybenzoate; Methoxybenzoic acid; anisic acid; BDBM23435; 4-methyoxybenzoate ion; A800042; p-methoxybenzoate; 4-Methoxybenzoic acidanion; CHEBI:16639; p-anisate; AC1MX20M; 4-methoxybenzoate, 4; ZB010665; 16285-97-5; CJ-02856; 4-methoxy benzoic acid; p-methoxybenzoic acid |
C8H8O3 |
152.15 |
COC1=CC=C(C=C1)C(=O)O |
|
TCMBANKIN061820 |
3-(4-methoxyphenyl)-2-propenal |
3-(4-methoxyphenyl)acrylaldehyde; (E)-3-(4-methoxyphenyl)prop-2-enal; p-methoxycinnamaldehyde; p-MeO-cinnamaldehyde; AXCXHFKZHDEKTP-NSCUHMNNSA-N; RP17390; CJ-05236; 4-Methoxycinnamaldehyde; p-Methoxy cinnamaldehyde; trans-p-Methoxycinnamaldehyde, analytical standard; I14-56551; para-METHOXY CINNAMIC ALDEHYDE (PMCA); KB-193129; ST2417372; BRD-K19243101-001-01-6; TL80073683; UNII-54098389BL; (2E)-3-(4-methoxyphenyl)acrylaldehyde; AMBZ0230; NSC-26454; trans-p-Methoxycinnamaldehyde; FEMA No. 3567; AI3-05957; trans-4-methoxy cinnamaldehyde; ZINC1531852; CHEMBL452173; MFCD00017343; ghl.PD_Mitscher_leg0.403; (2E)-3-(4-Methoxyphenyl)-2-propenal #; Cinnamaldehyde, p-methoxy-; AK306471; bmse010142; DTXSID1044308; J-501926; Para-methoxy cinnamaldehyde; NSC26454; NSC 26454; AKOS015851928; 2-Propenal, 3-(4-methoxyphenyl)-; BG01501139; p-methoxy cinnamaldehyde; NSC-134287; (2E)-3-(4-Methoxyphenyl)-2-propenal; AC1Q6PPJ; (E)-3-(4-methoxyphenyl)-2-propenal; Cinnamaldehyde, p-methoxy-, (E)-; PK04_096267; Cinnamaldehyde, p-methoxy- (8CI); 3-(4-Methoxyphenyl)-(2E)-2-propenal; (E)-para-methoxycinnamaldehyde; W356700_ALDRICH; InChI=1/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3/b3-2; NCGC00171001-01; 3-(4-methoxyphenyl)prop-2-enal; (E)-3-(4-methoxyphenyl)-acrylaldehyde; Methoxycinnamaldehyde, p-; RTR-009115; 3-(4-methoxyphenyl)acrolein; 2-propenal, 3-(4-methoxyphenyl)-, (2E)-; (E)-3-(4-methoxyphenyl)acrolein; EN300-96338; Z3586; EINECS 217-807-0; NSC134287; (2E)-3-(4-methoxyphenyl)prop-2-enal; 3-(4-Methoxyphenyl)-2-propenal; I01-9542; 24680-50-0; 4-methoxy cinnamaldehyde; (E)-3-(4-Methoxyphenyl)acrylaldehyde; (E)-4-methoxycinnamaldehyde; C10475; MolPort-020-168-614; 3-(4-Methoxyphenyl)propenal; trans-p-Methoxycinnamaldehyde, >=98%, stabilized; 1963-36-6; trans-4-Methoxycinnamaldehyde; 54098389BL; AJ-26736; p-Methoxycinnamic aldehyde; ST50827243; AC1LD2JJ; para-Methoxy cinnamic aldehyde; AK128287; M1012; TR-009115; SCHEMBL514958; ZINC01531852; p-methoxy-cinnamaldehyde;p-Methoxycinnamaldehyde |
C10H10O2 |
162.19 |
COC1=CC=C(C=C1)C=CC=O |
|
TCMBANKIN061822 |
4-methoxybenzaldehyde |
KS-000002NI; EC 204-602-6; anisaldehyd; 4-methoxylbenzaldehyde; SBB040224; FEMA No. 2670; DB-012818; 4-Methoxybenzaldehyde; 4-(methyloxy)benzaldehyde; A0480; MFCD00003385; CJ-01596; SC-26765; 4-Methoxybenzaldehyde, 98% 50g; bmse010130; AK-72956; BENZALDEHYDE,4-METHOXY MFC8 H8 O2; 4-methoxybenzoyl; 4-Anisaldehyde; NCGC00257076-01; AN-22903; EBD1062; I922; P-ANISALDEHYDE; p-Anisic aldehyde; p-Methoxybenzaldehyde; Anisaldehyde; anisal; 79582-EP2305698A2; 4-methoxybenzaldehye; BG01497623; C10761; EINECS 256-891-3; DSSTox_RID_78277; Methoxybenzaldehyde (Related); EINECS 204-602-6; KB-193002; BB_NC-2206; AS02988; NSC 5590; p-Anisaldehyde, natural, 98%, FG; Benzaldehyde, 4-methoxy-; 4-Methoxy-benzaldehyde; HMS3039F08; p-Methoxybenzylidenemalonitrile; DSSTox_GSID_26997; 4-methoxybenzene carboxaldehyde; I01-0482; 123-11-5; anisic aldehyde (natural); UNII-9PA5V6656V; RP20260; AJ-14902; p-Anisaldehyde, United States Pharmacopeia (USP) Reference Standard; Q-100105; 79582-EP2292628A2; ST50213373; Anisaldehyde solution; 79582-EP2374783A1; DTXSID2026997; p-Methoxy Benzaldehyde, Natural; NCGC00090807-01; KB-115367; ZINC157146; p-Anisaldehyde, primary pharmaceutical reference standard; AI3-00223; 68894-36-0; 79582-EP2298755A1; AC-10379; AC1L1L81; CHEMBL161598; p-Anisaldehyde, for synthesis, 98.0%; 4-methoxy-benzaldehyde; LS-20018; 29578-EP2308838A1; CAS-123-11-5; SCHEMBL1100; 29578-EP2311825A1; InChI=1/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H; SMR001224521; p-Anisaldehyde, 8CI; 29578-EP2305696A2; 4-08-00-00252 (Beilstein Handbook Reference); LS-2093; 79582-EP2305695A2; para-methoxybenzaldehyde; 26249-15-0; ZRSNZINYAWTAHE-UHFFFAOYSA-N; CHEBI:28235; NATURAL ANISIC ALDEHYDE; DSSTox_CID_6997; p-Formylanisole; Anisaldehyde; p-Anisaldehyde (4-Methoxybenzaldehyde); ACMC-1BAZN; 29578-EP2305695A2; Formylanisole, p-; WLN: VHR DO1; p-Anisaldehyde, 98%; p-Methoxybenzafdehyde; BRN 0471382; ZB006571; Caswell No. 051E; ST2411506; FT-0617622; 4-Methoxybenzaldhyde; p-Anisaldehyde, certified reference material, TraceCERT(R); KSC174M6D; 29578-EP2311842A2; NCGC00259492-01; p-Methoxybenzaldehyde (natural); p-Anisaldehyde, >=97.5%, FCC, FG; p-Methoxybenzaldehyde; Tox21_303331; 721942-53-6; p-Anisic aldehyde; 3-Chlorobenzenesulfonyl chloride, 98%; 79582-EP2305696A2; MLS002152921; RTR-003659; A805017; p-Anisaldehyde, analytical standard; 4-methoxy benzaldehyde; Anis aldehyde; para-anisaldehyde; 4-methoxybezaldehyde; HSDB 2641; 29578-EP2284160A1; PubChem22535; Aubepine; 29578-EP2305698A2; Jsp001555; I01-8766; ANW-18100; 79582-EP2305697A2; AKOS000118814; 29578-EP2292628A2; M-6033; Anisic aldehyde; CTK0H4661; BR-72956; TR-003659; TRA0080347; 79582-EP2287153A1; BBL027436; Tox21_201943; NCGC00090807-02; NSC-5590; para-methoxy benzaldehyde; Obepin; CCG-214805; MolPort-000-871-198; CS-W020189; FEMA 2670; Anisaldehyde (para); 79582-EP2377841A1; 29578-EP2305697A2; MCULE-9537754812; F2190-0575; 9PA5V6656V; p-methoxy benzaldehyde; AC1Q4CCF; NSC5590; CCRIS 821; BDBM50139370; Crategine;anisaldehyde;p-Anis aldehyde;AI3-00223; 4-Anisaldehyde; Crategine; 26249-15-0; p-Methoxybenzaldehyde (natural); EINECS 204-602-6; C10761; 19486-71-6; 68894-36-0; NSC 5590; 4-Methoxybenzaldehyde-; CCRIS 821; Aubepine; ZINC00157146; InChI=1/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H; WLN: VHR DO1; Anisaldehyde solution; (4-METHOXYPHENYL)((2)H)FORMALDEHYDE; Benzaldehyde, 4-methoxy-; Benzaldehyde, methoxy-; ST5213373; p-Formylanisole; W267007_ALDRICH; HSDB 2641; A-d1; 4-08-00-00252 (Beilstein Handbook Reference); deuterio-(4-methoxyphenyl)methanone; Obepin; p-Anisaldehyde; Aub+ pine; NSC5590; ANISALDEHYDE; 4-Methoxybenzaldehyde; 97063_FLUKA; 123-11-5; FEMA No. 2670; p-Anisic aldehyde; Caswell No. 051E; BRN 0471382; 50984-52-6; DTXSID40460063; A88107_ALDRICH; 4-Methoxybenzaldehyde-alpha-d1, 98 atom % D; 4-Methoxybenzaldehyde-alpha-d1; p-Methoxybenzaldehyde; Formylanisole, p-; BENZALDEHYDE,4-METHOXY MFC8 H8 O2; LS-2093; Anisic aldehyde; EINECS 256-891-3; NCGC00090807-01; Methoxybenzaldehyde; SRA1_SIAL; p-Anisaldehyde-;p-anisaldehyde |
C8H8O2 |
136.15 g/mol |
COC1=CC=C(C=C1)C=O |
|
TCMBANKIN061849 |
1-methoxy-4-(2-propenyl)-benzene |
4-Allylanisole;estragole;esdragol;Terragon;methylchavicol;CCRIS 1317; MolPort-000-156-967; MFCD00008653; Estragol (methylchavicol); DSSTox_CID_575; Anisole, p-allyl-; Esdragol; 1-allyl-4-methoxy-benzene; DTXSID0020575; 4-allylanisol; Methyl chavicole (estragole); p-Methoxyallylbenzene; Benzene, 1-methoxy-4-(2-propen-1-yl)-; NCGC00091434-01; chavicyl methylether; CTK7A3557; Methyl chavicole; UNII-9NIW07V3ET; Estragol; SR-01000838348; 4-06-00-03817 (Beilstein Handbook Reference); Ether, p-allylphenyl methyl; NSC 404113; Tarragon; 140-67-0; DSSTox_RID_75667; O080; Chavicol methyl ether; Benzene, 1-methoxy, 4-prop-2-enyl; AK109291; FEMA No. 2411; p-Allylphenyl methyl ether; p-allylanisole, 4-allyl-1-methoxybenzene, methyl chavicol; Chavicol, O-methyl-; NSC-404113; CHEMBL470671; CCG-214642; 4-Allylanisole, analytical standard; FEMA 2411; 1-METHOXY-4-(2-PROPENYL)BENZENE; FEMA Number 2411; EPA Pesticide Chemical Code 062150; 4-Allylmethoxybenzene; Benzene, 1-methoxy-4-(2-propenyl)-; HMS2268E24; SMR000112379; p-Allylanisole; SPECTRUM1505117; 1-methoxy-4-(prop-2-en-1-yl)benzene; Chavicyl methyl ether; chavicol methylether; C10452; NCI-C60946; Allylphenyl methyl ether, p-; estragon;p-allylanisole; EINECS 205-427-8; AI3-16052; Esteragol; ZINC967635; 4-Allylanisole, purum, >=97.0% (GC); CHEBI:4867; 1407-27-8; Estragole (natural); NCGC00259936-01; MLS001065575; 1-methoxy-4-prop-2-enylbenzene; Methyl chavicol; AC1Q4FE9; 1-Methoxy-4-(2-propen-1-yl)-Benzene; Methylchavicol; Chavicol, methyl-; p-Allyl-Anisole; ACMC-1BW75; KB-36193; 3-(p-Methoxyphenyl)propene; 1-methoxy-4-(2-propenyl)-benzene; InChI=1/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H; AKOS000121300; p-Allylmethoxybenzene; Methyl-Chavicol; AC1L1RR7; Tox21_302930; 3-(4-Methoxyphenyl)-1-propene; ST50824126; BRN 1099454; Isoanthethole; LS-821; Esdragon; ZFMSMUAANRJZFM-UHFFFAOYSA-N; I01-10181; Estragole, analytical standard; 9NIW07V3ET; O-Methyl-Chavicol; Terragon; 4-Allyl-1-methoxybenzene; BENZENE,1-ALLYL,4-METHOXY METHYLCHAVICOL; HSDB 5412; 4-Allylanisole, 98%; Chavicyl methyl ether; AN-17349; 1-Methoxy-4-(2-propenyl)benzene, 9CI; A0702; 4-Allylanisole; para-allylanisole; AC1Q4CFH; SCHEMBL57204; WLN: 1U2R DO1; SR-01000838348-2; FT-0617414; J-007415; NCGC00091434-02; TC-109325; CAS-140-67-0; isoanethole, 4-Allylanisole; ANW-20580; 4-Methoxyallylbenzene; Tox21_202387; Estragole; NSC404113; Esdragole; 77525-18-9; AJ-24538; DSSTox_GSID_20575; NCGC00091434-03; Para-allylanisole (estragole); ZB015470; BENZENE,1-ALLYL,4-METHOXY METHYLCHAVICOL; 1-Allyl-4-methoxybenzene; NCGC00256481-01; 4-Allylanisole, >=98%, FCC; 1-Methoxy-4-(2-propen-1-yl)benzene; Isoanethole;34098_RIEDEL; 3-(p-Methoxyphenyl)propene; InChI=1/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H; 1-METHOXY-4-(2-PROPENYL)BENZENE; Anisole, p-allyl-; EPA Pesticide Chemical Code 062150; 1-allyl-4-methoxy-benzene; Esdragol; FEMA Number 2411; p-Allylmethoxybenzene; NCGC00091434-02; 4-Allylmethoxybenzene; Benzene, 1-methoxy-4-(2-propenyl)-; p-Methoxyallylbenzene; 4-Methoxyallylbenzene; BRN 1099454; WLN: 1U2R DO1; SPECTRUM1505117; p-Allylanisole; LS-821; Esdragon; NCGC00091434-01; Estragol; Chavicyl methyl ether; C10452; Estragole; 4-06-00-03817 (Beilstein Handbook Reference); NSC404113; Esdragole; NCI-C60946; NSC 404113; 77525-18-9; 4-Allyl-1-methoxybenzene; Tarragon; 140-67-0; Allylphenyl methyl ether, p-; HSDB 5412; EINECS 205-427-8; ZINC00967635; AI3-16052; Isoanethole; 1-methoxy-4-prop-2-enyl-benzene; A29208_ALDRICH; 05820_FLUKA; Chavicol methyl ether; 05818_FLUKA; BENZENE,1-ALLYL,4-METHOXY METHYLCHAVICOL; 1407-27-8; W241105_ALDRICH; Estragole (natural); 1-Allyl-4-methoxybenzene; FEMA No. 2411; 4-Allylanisole; 1-Methoxy-4-(2-propen-1-yl)benzene; Chavicol, O-methyl-; 1-methoxy-4-prop-2-enylbenzene; Methyl chavicol; Methylchavicol |
C10H12O |
148.2 g/mol |
COC1=CC=C(C=C1)CC=C |
|
TCMBANKIN061861 |
m-Anisaldehyde |
3-Methoxybenzaldehyde; W513105_ALDRICH; 4-08-00-00241 (Beilstein Handbook Reference); 591-31-1; CCRIS 960; Metamethoxybenzaldehyde; 129658_ALDRICH; 3-Anisaldehyde; AI3-52556; m-Methoxybenzaldehyde; InChI=1/C8H8O2/c1-10-8-4-2-3-7(5-8)6-9/h2-6H,1H; ST5213433; Benzaldehyde, 3-methoxy-; BRN 0606013; 64780_FLUKA; NSC43794; NSC 43794; ZINC01676373; EINECS 209-712-8 |
C8H8O2 |
136.15 |
COC1=CC=CC(=C1)C=O |
|
TCMBANKIN061863 |
m-Guaiacol |
m-Hydroxyanisole; 3-(methyloxy)phenol; AIDS-017861; Resorcinol monomethyl ether; EINECS 205-754-6; Phenol, 3-methoxy-; NSC21735; InChI=1/C7H8O2/c1-9-7-4-2-3-6(8)5-7/h2-5,8H,1H; 150-19-6; 1-Hydroxy-3-methoxybenzene; AI3-00796; 3-Methoxyphenol; ZINC00389516; 3-METHOXY-PHENOL; 328456_ALDRICH; Phenol, m-methoxy-; m-Methoxyphenol; 3-Hydroxyanisole; Resorcinol methyl ether; 3-Hydroxyanisol; NSC 21735; AIDS01786; 3-methoxyphenol; RP19573; 4-hydroxy-2-methoxyphenyl; ZLC0026; BB_SC-6850; 4CN-1025; CS-D1677; M0122; m-Methoxyphenol; CAS-150-19-6; DTXSID0022012; 88189-EP2305648A1; HXB7441U87; NSC-21735; LABOTEST-BB LTBB002880; BDBM36297; 88189-EP2298750A1; 1-HYROXY-4-METHOXYBENZENE; LS-104768; 3-Methoxyphenol, analytical standard; KSC177G7R; m-methoxy-phenol; NSC 21735; METHOXYPHENOL, PARA-; AK105946; 3-methyloxyphenol; FT-0616005; AN-44011; SC-27007; ST2410764; META-METHOXYPHENOL; Resorcinol monomethyl ether; ZINC389516; Phenol, 3-methoxy-; AKOS000120300; InChI=1/C7H8O2/c1-9-7-4-2-3-6(8)5-7/h2-5,8H,1H; PARAGOS 500026; ANW-21265; AI3-00796; m-Guaiacol; Jsp002861; KS-00000V0W; AC1Q4E80; TR-006122; 3-Hydroxyanisole; CHEMBL57891; BG01496812; CHEBI:52678; ASHGTJPOSUFTGB-UHFFFAOYSA-N; DSSTox_CID_2012; DB-002515; AKOS AKM01253; SCHEMBL12015261; SC-06352; 3-Methoxyphenol, 96%; 88189-EP2269977A2; AC1L1S44; STL141067; ZB011737; m-Hydroxyanisol; 3-(methyloxy)phenol; MCULE-7145223398; 88189-EP2270006A1; BBL009702; NSC21735; NCGC00357098-01; 1-Hydroxy-3-methoxybenzene; SBB060932; LABOTEST-BB LTBB001936; ST51047026; OTAVA-BB 1366571; 3-METHOXYPHENOL; PubChem13577; L543; CK1184; METHOXYPHENOL(P-); UNII-HXB7441U87; 3-methoxy phenol; AS00218; MFCD00002267; KS-00000UG4; m-Hydroxyanisole; DSSTox_GSID_22012; I01-7331; zlchem 218; SCHEMBL28256; Tox21_303820; PARA METHOXY PHENOL; EINECS 205-754-6; 150-19-6; AJ-20809; 3-METHOXY-PHENOL; AC-18515; X-1701; Phenol, m-methoxy-; Resorcinol methyl ether; HYDROXYANISOLE-4; 88189-EP2277881A1; MolPort-001-785-031; 4-METHOXYPHEOL; Z1262395996; KB-32557; 3-Hydroxyanisol; AC1Q7AKN; ACMC-209d43; CTK0H7378; AS04315; W-108077; F0001-0533; RTR-006122 |
C7H8O2 |
124.14 |
COC1=CC=CC(=C1)O |
|
TCMBANKIN061865 |
Anizol |
Phenol methyl ether; HSDB 44; NSC7920; InChI=1/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H; FEMA No. 2097; Anisol; 100-66-3; Anisole [UN2222] [Flammable liquid]; METHOXY-BENZENE (ANISOL); Methyl phenyl ether; 123226_SIAL; W209708_ALDRICH; AIDS-017804; NSC 7920; CHEBI:16579; Benzene, methoxy-; WLN: 1OR; UN2222; Methoxybenzene; FEMA Number 2097; AI3-00042; 296295_ALDRICH; ZINC00897131; Benzene, methoxy; Phenoxymethane; 10520_FLUKA; Ether, methyl phenyl; Ether, methyl phenyl-; Anisole; AIDS017804; EINECS 202-876-1; C01403; Phenyl methyl ether; 96109_FLUKA;anisole |
C7H8O |
108.14 |
COC1=CC=CC=C1 |
|
TCMBANKIN061868 |
o-methoxy phenol |
2-methoxyphenol;guaiacol;Guasol;Catechol mono methyl ether; DSSTox_RID_77552; SMR000059155; ANW-13634; Anastil; WLN: QR BO1; 2-Methoxyphenol; Catechol monomethyl ether; Pyrocatechol monomethyl ether; CHEMBL13766; SCHEMBL21626; AI3-05615; DB-024854; 6JKA7MAH9C; Guajacol; Guaiacol (2-Methoxyphenol); 2-Methoxyphenol, 98% 250g; 2-methoxyphenol;; Methyl Catechol; CAS-90-05-1; Guaiacol, Pharmaceutical Secondary Standard; Certified Reference Material; HMS3372N11; Guaiacol [JAN:NF]; 2-Methoxy-Phenol; 3-hydroxy-2-methoxyphenyl; 2-methoxy phenol; SBB058681; a hydroxlyated aryl lignin fragment; NCGC00090827-06; Guaiacol, Vetec(TM) reagent grade, 98%; UNII-6JKA7MAH9C; D00117; 26638-03-9; 7519-EP2295426A1; 7519-EP2316470A2; Guaicol; Guaiacol, oxidation indicator; guaiacol; Creosote (wood); guiacol; SR-01000838056-3; 2-Hydroxyanisole; Creosote, beechwood; DTXSID0023113; 7519-EP2308857A1; CCRIS 6004; o-Hydroxyanisole; AJ-63992; ZINC13512224; SR-01000838056-2; EINECS 232-419-1; RCRA waste number U051; 7519-EP2305636A1; C01502; Beechwood creosote; 2-(methyloxy)phenol; 196981-EP2371803A1; SC-18105; A843426; HMS2233P04; LHGVFZTZFXWLCP-UHFFFAOYSA-N; Guaiacol, natural, >=99%, FG; HMS2089D18; AB00876226_07; Tox21_202990; MFCD00002185; Guaiastil; guaiacol (liquid) extra pure; bmse000436; NCGC00090827-03; CREOSOTE, WOOD; orthomethoxyphenol; AB00876226-06; 7519-EP2305683A1; 2-Methoxyphenol, Catechol monomethyl ether, Pyrocatechol monomethyl ether; NSC3815; Guaiacol [JAN]; methoxy phenol; AK114448; 6-methoxyphenol; Guajakol [Czech]; NCGC00090827-02; ST2410094; FEMA No. 2532; EC 201-964-7; CS-D1347; Methylcatachol; Guaiacol, SAJ first grade, >=98.0%; Creosote [JAN]; 7519-EP2308861A1; JZ3; STL281868; InChI=1/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H; o-Guiacol; HSDB 1979; NCGC00090827-01; SR-01000838056; M0121; 7519-EP2316832A1; DSSTox_CID_3113; o-methoxy-Phenol; Guaiacol (natural); Tox21_400004; Guaiacol, European Pharmacopoeia (EP) Reference Standard; ortho-Guaiacol; Guajakol; Phenol, 2-methoxy-; PS-3252; Guaicolina; ACMC-209784; EBD2205193; NSC-760376; Pyrocatechol monomethyl ether; 7519-EP2314584A1; D02JUW; NSC760376; C15572; AN-17339; 7519-EP2311839A1; Phenol, o-methoxy-; Wood creosote; 2-Methoxyphenol; Creosote; Tox21_111031; 7519-EP2314589A1; AB1001888; ortho-methoxyphenol; CCG-214035; bmse010027; Creosote (wood tar); AC1Q46B5; I01-6054; 1-Hydroxy-2-methoxybenzene; o--methoxyphenol; TR-028311; LS-1906; NCGC00090827-07; 7519-EP2316837A1; 7519-EP2316833A1; EINECS 201-964-7; BDBM50240369; 196981-EP2269977A2; KS-00000KSX; 1990/5/1; Guajol; AC1L19AA; ST50214385; 7519-EP2295427A1; o-Guaiacol; CAS-8021-39-4; Guasol; HSDB 4241; MLS001055375; NCGC00090827-04; 8021-39-4; RTR-028311; ghl.PD_Mitscher_leg0.900; DSSTox_RID_76880; Pyroguaiac acid; MolPort-000-871-969; NCGC00090827-05; UNII-3JYG22FD73; Beechwood creosote (Fagus spp.); Creodon (TN); Pharmakon1600-01506165; Hydroxyanisole; Nat.Guaiacol; F2173-0425; 2-methoxyl-4-vinylphenol; O-Methyl catechol; o-Methoxyphenol; Creodon; CTK1A4914; KB-30331; Guaiacol (JAN); NCGC00258688-01; Pyrocatechol methyl ester; DB11359; 7519-EP2311821A1; Methylcatechol; AKOS000118831; Guaiacol, puriss., 99%; 3JYG22FD73; NSC 3815; NCGC00260535-01; Catechol monomethyl ether; STR03604; Guaiacol, United States Pharmacopeia (USP) Reference Standard; HMS3715E11; 1- hydroxy-2-methoxybenzene; KSC204S1J; 7519-EP2292227A2; DSSTox_GSID_24853; 196981-EP2377843A1; FT-0626815; NSC-3815; MCULE-5627336368; Q-100002; CCRIS 2943; 2-methoxyphenol (guaiacol); CHEBI:28591; DSSTox_GSID_23113; Phenol, methoxy-; Tox21_201136;HSDB 4241; 90-05-1; Anastil; 8021-39-4; Guaicolina; ZINC00001521; WLN: QR BO1; ghl.PD_Mitscher_leg0.900; Pyrocatechol monomethyl ether; 50880_FLUKA; AI3-05615; Pyroguaiac acid; Guaiastil; Methoxyphenol; AIDS-107096; NCGC00090827-03; CREOSOTE, WOOD; Guajacol; Creodon (TN); NSC3815; Guaiacol [JAN]; C15572; Creodon; o-Methoxyphenol; 2-Methoxyphenol; Guajakol [Czech]; O-Methyl catechol; Phenol, o-methoxy-; NCGC00090827-02; Guaiacol (JAN); W253200_ALDRICH; D00117; FEMA No. 2532; Pyrocatechol methyl ester; Methylcatechol; 26638-03-9; Guaicol; CPD-400; NSC 3815; InChI=1/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H; guaiacol; NCGC00090827-01; Catechol monomethyl ether; G5502_SIGMA; ST5214385; 1-Hydroxy-2-methoxybenzene; 2-Hydroxyanisole; AIDS107096; o-Hydroxyanisole; Guaiacol (natural); EINECS 201-964-7; Phenol, 2-methoxy-; Guajol; CCRIS 2943; C01502; o-Guaiacol; CHEBI:28591; Phenol, methoxy- |
C7H8O2 |
124.14 g/mol |
COC1=CC=CC=C1O |
滇IICP备16009434号-1 |
Dai SX Lab