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2-Pyridinecarboxylic acid, 5-(3-methoxy-3-oxo-1-propenyl)-4,6-dimethyl-, methyl ester, (E)-
SpectraBase Compound ID FXHUNqOxnLt
InChI InChI=1S/C13H15NO4/c1-8-7-11(13(16)18-4)14-9(2)10(8)5-6-12(15)17-3/h5-7H,1-4H3/b6-5+
InChIKey INQQFOHHGNCKBW-AATRIKPKSA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5r2DtIuFFJJ
Name 2-Pyridinecarboxylic acid, 5-(3-methoxy-3-oxo-1-propenyl)-4,6-dimethyl-, methyl ester, (E)-
CAS Registry Number 90909-63-0
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Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-8-7-11(13(16)18-4)14-9(2)10(8)5-6-12(15)17-3/h5-7H,1-4H3/b6-5+
InChIKey INQQFOHHGNCKBW-AATRIKPKSA-N
Molecular Weight 249.266 g/mol
SMILES c1(nc(c(c(c1)C)\C=C\C(=O)OC)C)C(=O)OC
SPLASH splash10-067l-0960000000-c782227f01cbba81c531
Source of Spectrum K-117-1632-0
Synonyms Methyl 5-[(1E)-3-methoxy-3-oxo-1-propenyl]-4,6-dimethyl-2-pyridinecarboxylate Methyl ester of 5-[(E)-2-(methoxycarbonyl)ethenyl]-4,6-dimethyl-2-pyridinecarboxylic acid
Wiley ID 1252116