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2-(2-Chlorophenyl)-3-(4-methyl-3-nitro-phenyl)carbonyl-1,3-thiazolidine-4-carboxylic acid
SpectraBase Compound ID 6RS9HqZDokH
InChI InChI=1S/C18H15ClN2O5S/c1-10-6-7-11(8-14(10)21(25)26)16(22)20-15(18(23)24)9-27-17(20)12-4-2-3-5-13(12)19/h2-8,15,17H,9H2,1H3,(H,23,24)
InChIKey QQGWSJVHUOYLSA-UHFFFAOYSA-N
Mol Weight 406.84 g/mol
Molecular Formula C18H15ClN2O5S
Exact Mass 406.03902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXGZsJUJLXZ
Name 2-(2-Chlorophenyl)-3-(4-methyl-3-nitro-phenyl)carbonyl-1,3-thiazolidine-4-carboxylic acid
Alternate Name(s) 2-(2-Chlorophenyl)-3-(4-methyl-3-nitrobenzoyl)-1,3-thiazolidine-4-carboxylic acid 2-(2-Chlorophenyl)-3-[(4-methyl-3-nitrophenyl)-oxomethyl]-4-thiazolidinecarboxylic acid
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Formula C18H15ClN2O5S
InChI InChI=1S/C18H15ClN2O5S/c1-10-6-7-11(8-14(10)21(25)26)16(22)20-15(18(23)24)9-27-17(20)12-4-2-3-5-13(12)19/h2-8,15,17H,9H2,1H3,(H,23,24)
InChIKey QQGWSJVHUOYLSA-UHFFFAOYSA-N
Molecular Weight 406.840 g/mol
SMILES OC(C1N(C(SC1)c1c(Cl)cccc1)C(c1cc(N(=O)=O)c(cc1)C)=O)=O
SPLASH splash10-03xu-7900000000-85b4a2c663179ff4e477
Source of Spectrum AD-0-2532-0
Wiley ID 1435891