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4-Amino-5-cyano-6-methylsulfinyl-2-methyl-nicotinic acid ethyl ester
SpectraBase Compound ID 9O7GpUJ3yQO
InChI InChI=1S/C11H13N3O3S/c1-4-17-11(15)8-6(2)14-10(18(3)16)7(5-12)9(8)13/h4H2,1-3H3,(H2,13,14)
InChIKey VTNOZNJPMWJYMT-UHFFFAOYSA-N
Mol Weight 267.3 g/mol
Molecular Formula C11H13N3O3S
Exact Mass 267.067762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KIaEqJzemIi
Name 4-Amino-5-cyano-6-methylsulfinyl-2-methyl-nicotinic acid ethyl ester
Alternate Name(s) 4-Amino-5-cyano-2-methyl-6-methylsulfinyl-3-pyridinecarboxylic acid ethyl ester Ethyl 4-amino-5-cyano-2-methyl-6-methylsulfinylpyridine-3-carboxylate Ethyl 4-amino-5-cyano-2-methyl-6-methylsulfinyl-pyridine-3-carboxylate Ethyl 4-azanyl-5-cyano-2-methyl-6-methylsulfinyl-pyridine-3-carboxylate
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Formula C11H13N3O3S
InChI InChI=1S/C11H13N3O3S/c1-4-17-11(15)8-6(2)14-10(18(3)16)7(5-12)9(8)13/h4H2,1-3H3,(H2,13,14)
InChIKey VTNOZNJPMWJYMT-UHFFFAOYSA-N
Molecular Weight 267.303 g/mol
SMILES Nc1c(c(C)nc(c1C#N)S(=O)C)C(=O)OCC
SPLASH splash10-00or-0970000000-f61c0d625a3f637ee261
Source of Spectrum Y-47-176-7
Wiley ID 1667035