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3,3-DIPHENYL-3H-PYRAZOLE-4,5-DICARBOXYLIC ACID, DIMETHYL ESTER

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3,3-DIPHENYL-3H-PYRAZOLE-4,5-DICARBOXYLIC ACID, DIMETHYL ESTER
SpectraBase Compound ID AvkrjDssem4
InChI InChI=1S/C19H16N2O4/c1-24-17(22)15-16(18(23)25-2)20-21-19(15,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey CGQDKIGLEMFMOY-UHFFFAOYSA-N
Mol Weight 336.35 g/mol
Molecular Formula C19H16N2O4
Exact Mass 336.111007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9yOAYhBXgyW
Name 4,5-Bis(methoxycarbonyl)-3,3-diphenyl-3H-pyrazole
CAS Registry Number 31419-01-9
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H16N2O4
InChI InChI=1S/C19H16N2O4/c1-24-17(22)15-16(18(23)25-2)20-21-19(15,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey CGQDKIGLEMFMOY-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference H. Duerr, H. Kober, Chem. Ber. 107, 2037 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3