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2,4-pyridinedicarboxylic acid, 6-(2-(5-(ethoxycarbonyl)-1H-pyrrolo-3-yl)ethenyl)-dimethyl ester, (Z)-
SpectraBase Compound ID EWqf9dsVzMS
InChI InChI=1S/C18H18N2O6/c1-4-26-18(23)14-7-11(10-19-14)5-6-13-8-12(16(21)24-2)9-15(20-13)17(22)25-3/h5-10,19H,4H2,1-3H3/b6-5-
InChIKey HNYIGDRGIZABFP-WAYWQWQTSA-N
Mol Weight 358.35 g/mol
Molecular Formula C18H18N2O6
Exact Mass 358.116486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gu1dQdXiHPh
Name 2,4-pyridinedicarboxylic acid, 6-(2-(5-(ethoxycarbonyl)-1H-pyrrolo-3-yl)ethenyl)-dimethyl ester, (Z)-
CAS Registry Number 80721-39-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O6
InChI InChI=1S/C18H18N2O6/c1-4-26-18(23)14-7-11(10-19-14)5-6-13-8-12(16(21)24-2)9-15(20-13)17(22)25-3/h5-10,19H,4H2,1-3H3/b6-5-
InChIKey HNYIGDRGIZABFP-WAYWQWQTSA-N
Molecular Weight 358.350 g/mol
SMILES [nH]1cc(cc1C(=O)OCC)\C=C/c1nc(C(=O)OC)cc(c1)C(=O)OC
SPLASH splash10-06tb-0409000000-62906f440fc26959894c
Source of Spectrum J-50-1693-0
Synonyms Dimethyl 6-{(Z)-2-[5-(ethoxycarbonyl)-1H-pyrrol-3-yl]ethenyl}-2,4-pyridinedicarboxylate
Wiley ID 1346915