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Dimethyl 3-(4-Methylphenyl)-1-phenyl-1H-pyrazole-4,5-dicarboxylate
SpectraBase Compound ID HkLLDsUWhEb
InChI InChI=1S/C20H18N2O4/c1-13-9-11-14(12-10-13)17-16(19(23)25-2)18(20(24)26-3)22(21-17)15-7-5-4-6-8-15/h4-12H,1-3H3
InChIKey VLCCABJJCFHOSJ-UHFFFAOYSA-N
Mol Weight 350.37 g/mol
Molecular Formula C20H18N2O4
Exact Mass 350.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EKfP2A8ONBi
Name Dimethyl 3-(4-Methylphenyl)-1-phenyl-1H-pyrazole-4,5-dicarboxylate
Alternate Name(s) Dimethyl 1-phenyl-3-(p-tolyl)-1H-pyrazole-4,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N2O4
InChI InChI=1S/C20H18N2O4/c1-13-9-11-14(12-10-13)17-16(19(23)25-2)18(20(24)26-3)22(21-17)15-7-5-4-6-8-15/h4-12H,1-3H3
InChIKey VLCCABJJCFHOSJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200900246
Molecular Weight 350.374 g/mol
SMILES c1(n[n](c(c1C(=O)OC)C(=O)OC)-c1ccccc1)-c1ccc(cc1)C
SPLASH splash10-0v00-7009000000-98249870787637de19e6
Source of Spectrum H-93-279-3b
Wiley ID 1785799