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Methyl propyl pyridine-2-carboxylate-5-carboxythiolate
SpectraBase Compound ID 23ungeZlAEh
InChI InChI=1S/C11H13NO3S/c1-3-6-16-11(14)8-4-5-9(12-7-8)10(13)15-2/h4-5,7H,3,6H2,1-2H3
InChIKey NZSRVBMGXSANQV-UHFFFAOYSA-N
Mol Weight 239.29 g/mol
Molecular Formula C11H13NO3S
Exact Mass 239.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXp0cxZ4Rf4
Name Methyl propyl pyridine-2-carboxylate-5-carboxythiolate
Comments Less than 3 mono-isotopic peaks
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Formula C11H13NO3S
InChI InChI=1S/C11H13NO3S/c1-3-6-16-11(14)8-4-5-9(12-7-8)10(13)15-2/h4-5,7H,3,6H2,1-2H3
InChIKey NZSRVBMGXSANQV-UHFFFAOYSA-N
Molecular Weight 239.289 g/mol
SMILES c1(C(=O)SCCC)cnc(C(=O)OC)cc1
SPLASH splash10-03di-0900000000-6d2d6c5dd5a743d1d9ef
Source of Spectrum J-62-1787-3
Synonyms 5-Propylsulfanylcarbonyl-pyridine-2-carboxylic acid methyl ester propyl 5-[(methylsulfanyl)carbonyl]-2-pyridinecarboxylate 5-[oxo-(propylthio)methyl]-2-pyridinecarboxylic acid methyl ester methyl 5-propylsulfanylcarbonylpyridine-2-carboxylate
Wiley ID 1241760