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4-Amino-5-cyano-6-ethylsulfonyl-2-methyl-nicotinic acid methyl ester
SpectraBase Compound ID 506gMIufbQF
InChI InChI=1S/C11H13N3O4S/c1-4-19(16,17)10-7(5-12)9(13)8(6(2)14-10)11(15)18-3/h4H2,1-3H3,(H2,13,14)
InChIKey KMHQRDHWEXBCDE-UHFFFAOYSA-N
Mol Weight 283.3 g/mol
Molecular Formula C11H13N3O4S
Exact Mass 283.062677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CBBOesgPw
Name 4-Amino-5-cyano-6-ethylsulfonyl-2-methyl-nicotinic acid methyl ester
Alternate Name(s) 4-Amino-5-cyano-6-ethylsulfonyl-2-methyl-3-pyridinecarboxylic acid methyl ester Methyl 4-amino-5-cyano-6-ethylsulfonyl-2-methylpyridine-3-carboxylate Methyl 4-amino-5-cyano-6-ethylsulfonyl-2-methyl-pyridine-3-carboxylate Methyl 4-azanyl-5-cyano-6-ethylsulfonyl-2-methyl-pyridine-3-carboxylate
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Formula C11H13N3O4S
InChI InChI=1S/C11H13N3O4S/c1-4-19(16,17)10-7(5-12)9(13)8(6(2)14-10)11(15)18-3/h4H2,1-3H3,(H2,13,14)
InChIKey KMHQRDHWEXBCDE-UHFFFAOYSA-N
Molecular Weight 283.302 g/mol
SMILES Nc1c(c(S(=O)(=O)CC)nc(c1C(=O)OC)C)C#N
SPLASH splash10-0006-0930000000-5b57d6fb2f3e632a20a7
Source of Spectrum Y-47-176-5c
Wiley ID 1667036