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3-(3-Chlorobenzoyl)-2-(4-methylphenyl)-1,3-thiazolidine-4-carboxylic acid
SpectraBase Compound ID KGxBhQMyl9p
InChI InChI=1S/C18H16ClNO3S/c1-11-5-7-12(8-6-11)17-20(15(10-24-17)18(22)23)16(21)13-3-2-4-14(19)9-13/h2-9,15,17H,10H2,1H3,(H,22,23)
InChIKey KEHAOGCUVNGZOK-UHFFFAOYSA-N
Mol Weight 361.84 g/mol
Molecular Formula C18H16ClNO3S
Exact Mass 361.053942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7wiLdrnNswZ
Name 3-(3-Chlorobenzoyl)-2-(4-methylphenyl)-1,3-thiazolidine-4-carboxylic acid
Alternate Name(s) 3-(3-Chlorophenyl)carbonyl-2-(4-methylphenyl)-1,3-thiazolidine-4-carboxylic acid 3-[(3-chlorophenyl)-oxomethyl]-2-(4-methylphenyl)-4-thiazolidinecarboxylic acid
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Formula C18H16ClNO3S
InChI InChI=1S/C18H16ClNO3S/c1-11-5-7-12(8-6-11)17-20(15(10-24-17)18(22)23)16(21)13-3-2-4-14(19)9-13/h2-9,15,17H,10H2,1H3,(H,22,23)
InChIKey KEHAOGCUVNGZOK-UHFFFAOYSA-N
Molecular Weight 361.843 g/mol
SMILES OC(C1N(C(c2cc(Cl)ccc2)=O)C(SC1)c1ccc(cc1)C)=O
SPLASH splash10-000i-5900000000-6fa2f90bb19891622c76
Wiley ID 1451168