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2-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylpropanoic acid
SpectraBase Compound ID AYpLLfaCTdT
InChI InChI=1S/C12H11NO3S2/c14-10-7-18-12(17)13(10)9(11(15)16)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,15,16)
InChIKey UYEXYXVZQPTYSV-UHFFFAOYSA-N
Mol Weight 281.34 g/mol
Molecular Formula C12H11NO3S2
Exact Mass 281.018036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JamKtUF9coO
Name 2-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)-3-phenylpropanoic acid
Alternate Name(s) 2-(4-keto-2-thioxo-thiazolidin-3-yl)-3-phenyl-propionic acid 2-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-phenyl-propanoic acid 2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-phenylpropanoic acid 2-(4-oxo-2-sulfanylidene-3-thiazolidinyl)-3-phenylpropanoic acid 2-(4-oxo-2-thioxo-thiazolidin-3-yl)-3-phenyl-propanoic acid 2-(4-oxo-2-thioxo-thiazolidin-3-yl)-3-phenyl-propionic acid
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Formula C12H11NO3S2
InChI InChI=1S/C12H11NO3S2/c14-10-7-18-12(17)13(10)9(11(15)16)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,15,16)
InChIKey UYEXYXVZQPTYSV-UHFFFAOYSA-N
Molecular Weight 281.344 g/mol
SMILES OC(C(N1C(CSC1=S)=O)Cc1ccccc1)=O
SPLASH splash10-0002-6900000000-a2604f2a793ddf12036a
Wiley ID 1457152