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2-[4-(2-phenylethynyl)phenyl]-1,3-thiazolidine-4-carboxylic acid
SpectraBase Compound ID 3AFExT0D6Fd
InChI InChI=1S/C18H15NO2S/c20-18(21)16-12-22-17(19-16)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,16-17,19H,12H2,(H,20,21)
InChIKey FMMCEXVCWYTNEH-UHFFFAOYSA-N
Mol Weight 309.38 g/mol
Molecular Formula C18H15NO2S
Exact Mass 309.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6GD4sNhPO8e
Name 2-[4-(2-phenylethynyl)phenyl]-1,3-thiazolidine-4-carboxylic acid
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Formula C18H15NO2S
InChI InChI=1S/C18H15NO2S/c20-18(21)16-12-22-17(19-16)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,16-17,19H,12H2,(H,20,21)
InChIKey FMMCEXVCWYTNEH-UHFFFAOYSA-N
Molecular Weight 309.383 g/mol
SMILES N1C(SCC1C(=O)O)c1ccc(C#Cc2ccccc2)cc1
SPLASH splash10-0aou-3490000000-24fb1059ee6b6dd4437f
Synonyms 2-[4-(2-phenylethynyl)phenyl]-4-thiazolidinecarboxylic acid 2-[4-(2-phenylethynyl)phenyl]thiazolidine-4-carboxylic acid 2-[4-(phenylethynyl)phenyl]-1,3-thiazolidine-4-carboxylic acid
Wiley ID 1450921