For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-Pyrazole-4,5-dicarboxylic acid, 1-(4-methylphenyl)-3-phenyl-, dimethyl ester
SpectraBase Compound ID HsCEfswW4F9
InChI InChI=1S/C20H18N2O4/c1-13-9-11-15(12-10-13)22-18(20(24)26-3)16(19(23)25-2)17(21-22)14-7-5-4-6-8-14/h4-12H,1-3H3
InChIKey VHUIYPXNSOVAFR-UHFFFAOYSA-N
Mol Weight 350.37 g/mol
Molecular Formula C20H18N2O4
Exact Mass 350.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GHCQMELU4m8
Name 1H-Pyrazole-4,5-dicarboxylic acid, 1-(4-methylphenyl)-3-phenyl-, dimethyl ester
Alternate Name(s) Dimethyl 1-(4-methylphenyl)-3-phenyl-1H-pyrazole-4,5-dicarboxylate Dimethyl ester of 3-phenyl-1-(4-tolyl)pyrazole-4,5-dicarboxylic acid Pyrazole-4,5-dicarboxylic acid, 3-phenyl-1-p-tolyl-, dimethyl ester
CAS Registry Number 33743-48-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N2O4
InChI InChI=1S/C20H18N2O4/c1-13-9-11-15(12-10-13)22-18(20(24)26-3)16(19(23)25-2)17(21-22)14-7-5-4-6-8-14/h4-12H,1-3H3
InChIKey VHUIYPXNSOVAFR-UHFFFAOYSA-N
Molecular Weight 350.374 g/mol
SMILES c1(c(c(-c2ccccc2)n[n]1-c1ccc(cc1)C)C(=O)OC)C(=O)OC
SPLASH splash10-0uxr-3009000000-280dac57ca8527370b09
Source of Spectrum H-61-1503-0
Wiley ID 1341966