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Benzoic acid, 4-[3-(3-chlorophenyl)-4-oxo-2-thioxothiazolidin-5-ylidenemethyl]-
SpectraBase Compound ID DHrFrI6Egwt
InChI InChI=1S/C17H10ClNO3S2/c18-12-2-1-3-13(9-12)19-15(20)14(24-17(19)23)8-10-4-6-11(7-5-10)16(21)22/h1-9H,(H,21,22)/b14-8+
InChIKey OMLYNLORDBMPEM-RIYZIHGNSA-N
Mol Weight 375.84 g/mol
Molecular Formula C17H10ClNO3S2
Exact Mass 374.979063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6FdUcndQr8T
Name Benzoic acid, 4-[3-(3-chlorophenyl)-4-oxo-2-thioxothiazolidin-5-ylidenemethyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10ClNO3S2
InChI InChI=1S/C17H10ClNO3S2/c18-12-2-1-3-13(9-12)19-15(20)14(24-17(19)23)8-10-4-6-11(7-5-10)16(21)22/h1-9H,(H,21,22)/b14-8+
InChIKey OMLYNLORDBMPEM-RIYZIHGNSA-N
Molecular Weight 375.844 g/mol
SMILES OC(c1ccc(\C=C/2C(N(C(S2)=S)c2cc(Cl)ccc2)=O)cc1)=O
SPLASH splash10-004i-4901000000-79f2af23edc244db4bc7
Synonyms 4-[(E)-[3-(3-chlorophenyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid 4-[(E)-[3-(3-chlorophenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid 4-[(E)-[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid 4-[(E)-[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid 4-[(E)-[3-(3-chlorophenyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid 4-{[3-(3-chlorophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}benzoic acid
Wiley ID 1440167