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Diethyl 3-(4-Methylphenyl)-1-phenyl-1H-pyrazole-4,5-dicarboxylate
SpectraBase Compound ID DdvMvMQQDtr
InChI InChI=1S/C22H22N2O4/c1-4-27-21(25)18-19(16-13-11-15(3)12-14-16)23-24(17-9-7-6-8-10-17)20(18)22(26)28-5-2/h6-14H,4-5H2,1-3H3
InChIKey SLEKBFHZTYFXPM-UHFFFAOYSA-N
Mol Weight 378.43 g/mol
Molecular Formula C22H22N2O4
Exact Mass 378.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4S31RpdSuN1
Name Diethyl 3-(4-Methylphenyl)-1-phenyl-1H-pyrazole-4,5-dicarboxylate
Alternate Name(s) Diethyl 1-phenyl-3-(p-tolyl)-1H-pyrazole-4,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O4
InChI InChI=1S/C22H22N2O4/c1-4-27-21(25)18-19(16-13-11-15(3)12-14-16)23-24(17-9-7-6-8-10-17)20(18)22(26)28-5-2/h6-14H,4-5H2,1-3H3
InChIKey SLEKBFHZTYFXPM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200900246
Molecular Weight 378.428 g/mol
SMILES c1([n](nc(c1C(=O)OCC)-c1ccc(cc1)C)-c1ccccc1)C(=O)OCC
SPLASH splash10-004i-8009000000-63dc301a49c6f23eed20
Source of Spectrum H-93-279-3d
Wiley ID 1785801