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4-Amino-5-cyano-6-methylsulfonyl-2-methyl-nicotinic acid methyl ester
SpectraBase Compound ID INy7ofGAVGS
InChI InChI=1S/C10H11N3O4S/c1-5-7(10(14)17-2)8(12)6(4-11)9(13-5)18(3,15)16/h1-3H3,(H2,12,13)
InChIKey CQIBPTYDATVOAE-UHFFFAOYSA-N
Mol Weight 269.27 g/mol
Molecular Formula C10H11N3O4S
Exact Mass 269.047027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37428fiXWHr
Name 4-Amino-5-cyano-6-methylsulfonyl-2-methyl-nicotinic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3O4S
InChI InChI=1S/C10H11N3O4S/c1-5-7(10(14)17-2)8(12)6(4-11)9(13-5)18(3,15)16/h1-3H3,(H2,12,13)
InChIKey CQIBPTYDATVOAE-UHFFFAOYSA-N
Molecular Weight 269.275 g/mol
SMILES Nc1c(c(S(=O)(=O)C)nc(c1C(=O)OC)C)C#N
SPLASH splash10-056r-0950000000-5d853853f55f053653d0
Source of Spectrum Y-47-176-5a
Synonyms 4-Amino-5-cyano-2-methyl-6-methylsulfonyl-3-pyridinecarboxylic acid methyl ester Methyl 4-amino-5-cyano-2-methyl-6-methylsulfonylpyridine-3-carboxylate Methyl 4-amino-5-cyano-2-methyl-6-methylsulfonyl-pyridine-3-carboxylate Methyl 4-azanyl-5-cyano-2-methyl-6-methylsulfonyl-pyridine-3-carboxylate
Wiley ID 1667038