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4-Amino-5-cyano-6-ethylsulfanyl-2-methyl-nicotinic acid ethyl ester
SpectraBase Compound ID KKzMvwauCKP
InChI InChI=1S/C12H15N3O2S/c1-4-17-12(16)9-7(3)15-11(18-5-2)8(6-13)10(9)14/h4-5H2,1-3H3,(H2,14,15)
InChIKey VECRWOCKTAURQE-UHFFFAOYSA-N
Mol Weight 265.33 g/mol
Molecular Formula C12H15N3O2S
Exact Mass 265.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xUhKTA3Tk
Name 4-Amino-5-cyano-6-ethylsulfanyl-2-methyl-nicotinic acid ethyl ester
Alternate Name(s) 4-Amino-5-cyano-6-(ethylthio)-2-methyl-3-pyridinecarboxylic acid ethyl ester Ethyl 4-amino-5-cyano-6-ethylsulfanyl-2-methylpyridine-3-carboxylate Ethyl 4-amino-5-cyano-6-ethylsulfanyl-2-methyl-pyridine-3-carboxylate Ethyl 4-azanyl-5-cyano-6-ethylsulfanyl-2-methyl-pyridine-3-carboxylate
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Formula C12H15N3O2S
InChI InChI=1S/C12H15N3O2S/c1-4-17-12(16)9-7(3)15-11(18-5-2)8(6-13)10(9)14/h4-5H2,1-3H3,(H2,14,15)
InChIKey VECRWOCKTAURQE-UHFFFAOYSA-N
Molecular Weight 265.331 g/mol
SMILES Nc1c(C#N)c(nc(c1C(=O)OCC)C)SCC
SPLASH splash10-0pcc-0940000000-2fec0896898443053a48
Source of Spectrum Y-47-176-4d
Wiley ID 1667041