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4-Amino-5-cyano-2-methyl-6-methylsulfanyl-nicotinic acid methyl ester
SpectraBase Compound ID LesdzYy0uEv
InChI InChI=1S/C10H11N3O2S/c1-5-7(10(14)15-2)8(12)6(4-11)9(13-5)16-3/h1-3H3,(H2,12,13)
InChIKey BUZHDFXEMZDDJN-UHFFFAOYSA-N
Mol Weight 237.28 g/mol
Molecular Formula C10H11N3O2S
Exact Mass 237.057198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9AitvnOUZ5P
Name 4-Amino-5-cyano-2-methyl-6-methylsulfanyl-nicotinic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3O2S
InChI InChI=1S/C10H11N3O2S/c1-5-7(10(14)15-2)8(12)6(4-11)9(13-5)16-3/h1-3H3,(H2,12,13)
InChIKey BUZHDFXEMZDDJN-UHFFFAOYSA-N
Molecular Weight 237.277 g/mol
SMILES Nc1c(C#N)c(nc(c1C(=O)OC)C)SC
SPLASH splash10-000i-0190000000-ffaaea8f78f424ffac02
Source of Spectrum Y-47-174-4a
Synonyms 4-Amino-5-cyano-2-methyl-6-(methylthio)-3-pyridinecarboxylic acid methyl ester Methyl 4-amino-5-cyano-2-methyl-6-methylsulfanylpyridine-3-carboxylate Methyl 4-amino-5-cyano-2-methyl-6-methylsulfanyl-pyridine-3-carboxylate Methyl 4-azanyl-5-cyano-2-methyl-6-methylsulfanyl-pyridine-3-carboxylate
Wiley ID 1667044