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5-Cyano-6-ethylsulfanyl-2-hydroxy-nicotinic acid ethyl ester
SpectraBase Compound ID 1AuWMnjyDqI
InChI InChI=1S/C11H12N2O3S/c1-3-16-11(15)8-5-7(6-12)10(17-4-2)13-9(8)14/h5H,3-4H2,1-2H3,(H,13,14)
InChIKey WFNDKUJDFGVRHT-UHFFFAOYSA-N
Mol Weight 252.29 g/mol
Molecular Formula C11H12N2O3S
Exact Mass 252.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MwKs6NxXk
Name 5-Cyano-6-ethylsulfanyl-2-hydroxy-nicotinic acid ethyl ester
Alternate Name(s) 5-cyano-6-(ethylthio)-2-keto-1H-pyridine-3-carboxylic acid ethyl ester 5-cyano-6-(ethylthio)-2-oxo-1H-pyridine-3-carboxylic acid ethyl ester Ethyl 5-cyano-6-ethylsulfanyl-2-oxidanylidene-1H-pyridine-3-carboxylate Ethyl 5-cyano-6-ethylsulfanyl-2-oxo-1H-pyridine-3-carboxylate
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Formula C11H12N2O3S
InChI InChI=1S/C11H12N2O3S/c1-3-16-11(15)8-5-7(6-12)10(17-4-2)13-9(8)14/h5H,3-4H2,1-2H3,(H,13,14)
InChIKey WFNDKUJDFGVRHT-UHFFFAOYSA-N
Molecular Weight 252.288 g/mol
SMILES Oc1nc(c(cc1C(=O)OCC)C#N)SCC
SPLASH splash10-0a6r-6950000000-9df63441d7d492f14934
Wiley ID 1460990