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2-sulfanylidene-1H-pyridine-3-carboxylic acid
SpectraBase Compound ID BouN5wEUnWz
InChI InChI=1S/C6H5NO2S/c8-6(9)4-2-1-3-7-5(4)10/h1-3H,(H,7,10)(H,8,9)
InChIKey WYKHFQKONWMWQM-UHFFFAOYSA-N
Mol Weight 155.17 g/mol
Molecular Formula C6H5NO2S
Exact Mass 155.0041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQfWwMR6hO2
Name 3-Pyridinecarboxylic acid, 1,2-dihydro-2-thioxo-
Alternate Name(s) 2-Mercaptonicotinic acid 2-Mercaptopyridine-3-carboxylic acid 2-sulfanylidene-1H-pyridine-3-carboxylic acid 2-sulfanylnicotinic acid 2-Thioxo-1H-pyridine-3-carboxylic acid
CAS Registry Number 38521-46-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5NO2S
InChI InChI=1S/C6H5NO2S/c8-6(9)4-2-1-3-7-5(4)10/h1-3H,(H,7,10)(H,8,9)
InChIKey WYKHFQKONWMWQM-UHFFFAOYSA-N
Molecular Weight 155.171 g/mol
SMILES Sc1ncccc1C(O)=O
SPLASH splash10-0i00-9300000000-164317c1e03521147d8c
Source of Spectrum Y-22-774-14
Wiley ID 1152584