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Diethyl 5-(4-chlorophenyl)-1-phenyl-1H-pyrazole-3,4-dicarboxylate
SpectraBase Compound ID BVfCKA9fj8S
InChI InChI=1S/C21H19ClN2O4/c1-3-27-20(25)17-18(21(26)28-4-2)23-24(16-8-6-5-7-9-16)19(17)14-10-12-15(22)13-11-14/h5-13H,3-4H2,1-2H3
InChIKey YHCMBSLNGKICKJ-UHFFFAOYSA-N
Mol Weight 398.85 g/mol
Molecular Formula C21H19ClN2O4
Exact Mass 398.103335 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdfGQ2TlKkv
Name Diethyl 5-(4-chlorophenyl)-1-phenyl-1H-pyrazole-3,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19ClN2O4
InChI InChI=1S/C21H19ClN2O4/c1-3-27-20(25)17-18(21(26)28-4-2)23-24(16-8-6-5-7-9-16)19(17)14-10-12-15(22)13-11-14/h5-13H,3-4H2,1-2H3
InChIKey YHCMBSLNGKICKJ-UHFFFAOYSA-N
Molecular Weight 398.846 g/mol
SMILES c1(c(n[n](c1-c1ccc(cc1)Cl)-c1ccccc1)C(=O)OCC)C(=O)OCC
SPLASH splash10-0fba-4049100000-bcdb1f5132281da9d6e7
Source of Spectrum F-66-9838-7f
Wiley ID 1685231