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1-phenyl-2-sulfanylidene-3-pyridinecarboxylic acid
SpectraBase Compound ID CbRJ0lkNe6T
InChI InChI=1S/C12H9NO2S/c14-12(15)10-7-4-8-13(11(10)16)9-5-2-1-3-6-9/h1-8H,(H,14,15)
InChIKey IXDSRQYTNQWXRJ-UHFFFAOYSA-N
Mol Weight 231.27 g/mol
Molecular Formula C12H9NO2S
Exact Mass 231.0354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Lib0uStmU7
Name 1-phenyl-2-sulfanylidene-3-pyridinecarboxylic acid
CAS Registry Number 91540-58-8
Comments Less than 3 mono-isotopic peaks
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Formula C12H9NO2S
InChI InChI=1S/C12H9NO2S/c14-12(15)10-7-4-8-13(11(10)16)9-5-2-1-3-6-9/h1-8H,(H,14,15)
InChIKey IXDSRQYTNQWXRJ-UHFFFAOYSA-N
Molecular Weight 231.269 g/mol
SMILES OC(C=1C(N(C=CC1)c1ccccc1)=S)=O
SPLASH splash10-001i-0190000000-6d8622f18d588c4817b8
Source of Spectrum Y-21-45-4
Synonyms 1-phenyl-2-sulfanylidene-pyridine-3-carboxylic acid 1-phenyl-2-thioxo-nicotinic acid 1-phenyl-2-thioxo-pyridine-3-carboxylic acid
Wiley ID 1232638