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3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(4-ethyl-phenyl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID 6BKcXSMSTCA
InChI InChI=1S/C23H20BrClN2/c1-2-16-3-13-21(14-4-16)27-23(18-7-11-20(25)12-8-18)15-22(26-27)17-5-9-19(24)10-6-17/h3-14,23H,2,15H2,1H3
InChIKey PBDNRYRNOPKWML-UHFFFAOYSA-N
Mol Weight 439.78 g/mol
Molecular Formula C23H20BrClN2
Exact Mass 438.049839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6iP6IqmwQjd
Name 3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(4-ethyl-phenyl)-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20BrClN2
InChI InChI=1S/C23H20BrClN2/c1-2-16-3-13-21(14-4-16)27-23(18-7-11-20(25)12-8-18)15-22(26-27)17-5-9-19(24)10-6-17/h3-14,23H,2,15H2,1H3
InChIKey PBDNRYRNOPKWML-UHFFFAOYSA-N
Molecular Weight 439.784 g/mol
SMILES CCc1ccc(N2N=C(c3ccc(cc3)Br)CC2c2ccc(Cl)cc2)cc1
SPLASH splash10-000f-0100900000-f0ebb21f4c0ba42526a5
Wiley ID 1437227