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DIMETHYL-2-CYANO-3-(5-CYANO-6-QUINOLYLAMINO)-BUTENEDIOATE
SpectraBase Compound ID GsLrqrjXd9R
InChI InChI=1S/C17H12N4O4/c1-24-16(22)12(9-19)15(17(23)25-2)21-14-6-5-13-10(11(14)8-18)4-3-7-20-13/h3-7,21H,1-2H3/b15-12+
InChIKey YBHVWYJQRXIDQI-NTCAYCPXSA-N
Mol Weight 336.31 g/mol
Molecular Formula C17H12N4O4
Exact Mass 336.085855 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhEuqzJ0VH1
Name DIMETHYL-2-CYANO-3-(5-CYANO-6-QUINOLYLAMINO)-BUTENEDIOATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H12N4O4
InChI InChI=1S/C17H12N4O4/c1-24-16(22)12(9-19)15(17(23)25-2)21-14-6-5-13-10(11(14)8-18)4-3-7-20-13/h3-7,21H,1-2H3/b15-12+
InChIKey YBHVWYJQRXIDQI-NTCAYCPXSA-N
Literature Reference Author A.HALAMA,J.KAVALEK,V.MACHACEK,T.WEIDLICH
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1839(1999)
Literature Reference DOI 10.1039/a901773i
Molecular Weight 336.307 g/mol
Solvent DMSO-D6
Source File Reference UWRU5589