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6-[[(E)-1,4-dimethoxy-1,4-dioxobut-2-en-2-yl]amino]-2-(methylthio)pyridine-3,4-dicarboxylic acid dimethyl ester
SpectraBase Compound ID F7e9Pfdt2gb
InChI InChI=1S/C16H18N2O8S/c1-23-11(19)7-9(15(21)25-3)17-10-6-8(14(20)24-2)12(16(22)26-4)13(18-10)27-5/h6-7H,1-5H3,(H,17,18)/b9-7+
InChIKey ZLCQKNLQBYRPDR-VQHVLOKHSA-N
Mol Weight 398.39 g/mol
Molecular Formula C16H18N2O8S
Exact Mass 398.078387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9reBrNV8bkN
Name 6-[[(E)-1,4-dimethoxy-1,4-dioxobut-2-en-2-yl]amino]-2-(methylthio)pyridine-3,4-dicarboxylic acid dimethyl ester
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Formula C16H18N2O8S
InChI InChI=1S/C16H18N2O8S/c1-23-11(19)7-9(15(21)25-3)17-10-6-8(14(20)24-2)12(16(22)26-4)13(18-10)27-5/h6-7H,1-5H3,(H,17,18)/b9-7+
InChIKey ZLCQKNLQBYRPDR-VQHVLOKHSA-N
Molecular Weight 398.386 g/mol
SMILES N(\C(=C\C(=O)OC)C(=O)OC)c1cc(c(c(n1)SC)C(=O)OC)C(=O)OC
SPLASH splash10-0a4r-1009000000-57bb92ebe31ad589e5d8
Source of Spectrum F-50-10354-6
Synonyms 6-[[(E)-1-carbomethoxy-3-keto-3-methoxy-prop-1-enyl]amino]-2-(methylthio)pyridine-3,4-dicarboxylic acid dimethyl ester Dimethyl 6-[[(E)-1,4-dimethoxy-1,4-bis(oxidanylidene)but-2-en-2-yl]amino]-2-methylsulfanyl-pyridine-3,4-dicarboxylate Dimethyl 6-[[(E)-1,4-dimethoxy-1,4-dioxobut-2-en-2-yl]amino]-2-methylsulfanylpyridine-3,4-dicarboxylate Dimethyl 6-[[(E)-3-methoxy-1-methoxycarbonyl-3-oxo-prop-1-enyl]amino]-2-methylsulfanyl-pyridine-3,4-dicarboxylate
Wiley ID 789231