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(4-Bromo-phenyl)-((3S,4R)-2,4-diphenyl-5-trifluoromethyl-3,4-dihydro-2H-pyrazol-3-yl)-methanone
SpectraBase Compound ID HLCezUakkFX
InChI InChI=1S/C23H16BrF3N2O/c24-17-13-11-16(12-14-17)21(30)20-19(15-7-3-1-4-8-15)22(23(25,26)27)28-29(20)18-9-5-2-6-10-18/h1-14,19-20H/t19-,20+/m1/s1
InChIKey RJCRWEGHHBCCSY-UXHICEINSA-N
Mol Weight 473.29 g/mol
Molecular Formula C23H16BrF3N2O
Exact Mass 472.039811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83gXI17tvsO
Name (4-Bromo-phenyl)-((3S,4R)-2,4-diphenyl-5-trifluoromethyl-3,4-dihydro-2H-pyrazol-3-yl)-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16BrF3N2O
InChI InChI=1S/C23H16BrF3N2O/c24-17-13-11-16(12-14-17)21(30)20-19(15-7-3-1-4-8-15)22(23(25,26)27)28-29(20)18-9-5-2-6-10-18/h1-14,19-20H/t19-,20+/m1/s1
InChIKey RJCRWEGHHBCCSY-UXHICEINSA-N
Molecular Weight 473.293 g/mol
SMILES C1(=NN(c2ccccc2)[C@@]([C@]1(c1ccccc1)[H])(C(c1ccc(cc1)Br)=O)[H])C(F)(F)F
SPLASH splash10-000i-4090000000-5d46adae367f7caf480e
Source of Spectrum F4-43-2771-4f
Synonyms (4-Bromophenyl)[1,4-diphenyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-yl]methanone (4-bromophenyl)-[(3S,4R)-2,4-diphenyl-5-(trifluoromethyl)-3,4-dihydropyrazol-3-yl]methanone
Wiley ID 1676140