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2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-2-methyl-propanoic acid
SpectraBase Compound ID 5cqMOumA1xP
InChI InChI=1S/C11H12N2O2S/c1-7-4-5-8(6-12)9(13-7)16-11(2,3)10(14)15/h4-5H,1-3H3,(H,14,15)
InChIKey DKKSCXGVYADFIJ-UHFFFAOYSA-N
Mol Weight 236.29 g/mol
Molecular Formula C11H12N2O2S
Exact Mass 236.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5LqdPRGN5G9
Name 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-2-methyl-propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O2S
InChI InChI=1S/C11H12N2O2S/c1-7-4-5-8(6-12)9(13-7)16-11(2,3)10(14)15/h4-5H,1-3H3,(H,14,15)
InChIKey DKKSCXGVYADFIJ-UHFFFAOYSA-N
Molecular Weight 236.289 g/mol
SMILES OC(=O)C(C)(C)Sc1nc(ccc1C#N)C
SPLASH splash10-0zfr-7900000000-e2ca50e741dbad95a7e9
Synonyms 2-[(3-cyano-6-methyl-2-pyridinyl)thio]-2-methylpropanoic acid 2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-2-methyl-propanoic acid 2-[(3-cyano-6-methyl-2-pyridyl)thio]-2-methyl-propionic acid Propionic acid, 2-(3-cyano-6-methylpyridin-2-ylsulfanyl)-2-methyl-
Wiley ID 1440790