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3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(3-nitro-phenyl)-4,5-dihydro-1H-pyrazole

View entire compound with spectra: 1 MS (GC)

3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(3-nitro-phenyl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID 2xyE1gCpnaQ
InChI InChI=1S/C21H15BrClN3O2/c22-16-8-4-14(5-9-16)20-13-21(15-6-10-17(23)11-7-15)25(24-20)18-2-1-3-19(12-18)26(27)28/h1-12,21H,13H2
InChIKey HQJWWFORMFWRIJ-UHFFFAOYSA-N
Mol Weight 456.73 g/mol
Molecular Formula C21H15BrClN3O2
Exact Mass 455.003617 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ld4QQx51sp
Name 3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(3-nitro-phenyl)-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15BrClN3O2
InChI InChI=1S/C21H15BrClN3O2/c22-16-8-4-14(5-9-16)20-13-21(15-6-10-17(23)11-7-15)25(24-20)18-2-1-3-19(12-18)26(27)28/h1-12,21H,13H2
InChIKey HQJWWFORMFWRIJ-UHFFFAOYSA-N
Molecular Weight 456.727 g/mol
SMILES c1cc(N(=O)=O)cc(N2N=C(c3ccc(Br)cc3)CC2c2ccc(cc2)Cl)c1
SPLASH splash10-0a4i-1102900000-eb11afc1a9896ca45042
Wiley ID 1437246