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3-(FORMYLMETHOXY)-4,5-DIHYDRO-4-(METHOXYCARBONYL)-1,1-DIMETHYL-5-OXO-1H-PYRAZOLO-1-IUM-4-IDE
SpectraBase Compound ID CQnyRbsRJS2
InChI InChI=1S/C9H13N2O5/c1-11(2)8(13)6(9(14)15-3)7(10-11)16-5-4-12/h4,6H,5H2,1-3H3/q+1
InChIKey CENUIHUKNVGNLQ-UHFFFAOYSA-N
Mol Weight 229.21 g/mol
Molecular Formula C9H13N2O5
Exact Mass 229.082447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A1KOWzWGb2b
Name 3-(FORMYLMETHOXY)-4,5-DIHYDRO-4-(METHOXYCARBONYL)-1,1-DIMETHYL-5-OXO-1H-PYRAZOLO-1-IUM-4-IDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N2O5
InChI InChI=1S/C9H13N2O5/c1-11(2)8(13)6(9(14)15-3)7(10-11)16-5-4-12/h4,6H,5H2,1-3H3/q+1
InChIKey CENUIHUKNVGNLQ-UHFFFAOYSA-N
Literature Reference Author R.NEIDLEIN,G.SCHROEDER,C.KRIEGER,D.KIKELJ
Literature Reference Citation HELV.CHIM.ACTA,75,1039(1992)
Literature Reference DOI 10.1002/hlca.19920750407
Molecular Weight 229.213 g/mol
Solvent CDCl3
Source File Reference UWCS8828