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3,6-dimethylpyridazine-4,5-dicarboxylic acid O5-(benzyl) O4-ethyl ester
SpectraBase Compound ID YY9XkascVO
InChI InChI=1S/C17H18N2O4/c1-4-22-16(20)14-11(2)18-19-12(3)15(14)17(21)23-10-13-8-6-5-7-9-13/h5-9H,4,10H2,1-3H3
InChIKey BEOTWNHQTUBAQG-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C17H18N2O4
Exact Mass 314.126657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FGqmH3Szhyi
Name 3,6-dimethylpyridazine-4,5-dicarboxylic acid O5-(benzyl) O4-ethyl ester
Compound Number 9M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N2O4
InChI InChI=1S/C17H18N2O4/c1-4-22-16(20)14-11(2)18-19-12(3)15(14)17(21)23-10-13-8-6-5-7-9-13/h5-9H,4,10H2,1-3H3
InChIKey BEOTWNHQTUBAQG-UHFFFAOYSA-N
Literature Reference Author O.A.ATTANASI,P.FILIPPONE,C.FIORUCCI,E.FORESTI,F.MANTELLINI
Literature Reference Citation J.ORG.CHEM.,63,9880(1998)
Literature Reference DOI 10.1021/jo9816515
Molecular Weight 314.341 g/mol
Sample ID 27040
Solvent CDCl3