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4-Amino-5-cyano-2-methyl-6-butylamino-nicotinic acid methyl ester
SpectraBase Compound ID EzZisjElFjY
InChI InChI=1S/C13H18N4O2/c1-4-5-6-16-12-9(7-14)11(15)10(8(2)17-12)13(18)19-3/h4-6H2,1-3H3,(H3,15,16,17)
InChIKey BKTXSWAVEKZEHD-UHFFFAOYSA-N
Mol Weight 262.31 g/mol
Molecular Formula C13H18N4O2
Exact Mass 262.142976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 883FLz3sKBK
Name 4-Amino-5-cyano-2-methyl-6-butylamino-nicotinic acid methyl ester
Alternate Name(s) 4-Amino-6-(butylamino)-5-cyano-2-methyl-3-pyridinecarboxylic acid methyl ester Methyl 4-amino-6-(butylamino)-5-cyano-2-methylpyridine-3-carboxylate Methyl 4-amino-6-(butylamino)-5-cyano-2-methyl-pyridine-3-carboxylate Methyl 4-azanyl-6-(butylamino)-5-cyano-2-methyl-pyridine-3-carboxylate
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Formula C13H18N4O2
InChI InChI=1S/C13H18N4O2/c1-4-5-6-16-12-9(7-14)11(15)10(8(2)17-12)13(18)19-3/h4-6H2,1-3H3,(H3,15,16,17)
InChIKey BKTXSWAVEKZEHD-UHFFFAOYSA-N
Molecular Weight 262.313 g/mol
SMILES N(c1c(c(c(c(n1)C)C(=O)OC)N)C#N)CCCC
SPLASH splash10-067r-0590000000-e1a732e43262178ec305
Source of Spectrum Y-47-178-8m
Wiley ID 1667025