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[(3S,4R)-4-(2-Fluoro-phenyl)-2-phenyl-5-trifluoromethyl-3,4-dihydro-2H-pyrazol-3-yl]-phenyl-methanone
SpectraBase Compound ID HUXjQAnXAxE
InChI InChI=1S/C23H16F4N2O/c24-18-14-8-7-13-17(18)19-20(21(30)15-9-3-1-4-10-15)29(16-11-5-2-6-12-16)28-22(19)23(25,26)27/h1-14,19-20H/t19-,20+/m1/s1
InChIKey XHWNCKUGGJEUAE-UXHICEINSA-N
Mol Weight 412.39 g/mol
Molecular Formula C23H16F4N2O
Exact Mass 412.119876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5r4gbZUWbq1
Name [(3S,4R)-4-(2-Fluoro-phenyl)-2-phenyl-5-trifluoromethyl-3,4-dihydro-2H-pyrazol-3-yl]-phenyl-methanone
Alternate Name(s) [4-(2-Fluorophenyl)-1-phenyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-yl](phenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16F4N2O
InChI InChI=1S/C23H16F4N2O/c24-18-14-8-7-13-17(18)19-20(21(30)15-9-3-1-4-10-15)29(16-11-5-2-6-12-16)28-22(19)23(25,26)27/h1-14,19-20H/t19-,20+/m1/s1
InChIKey XHWNCKUGGJEUAE-UXHICEINSA-N
Molecular Weight 412.388 g/mol
SMILES C1(=NN(c2ccccc2)[C@@]([C@]1(c1c(F)cccc1)[H])(C(=O)c1ccccc1)[H])C(F)(F)F
SPLASH splash10-0a6r-3139000000-c94fa010e0eb1edbc579
Source of Spectrum F4-43-2773-4l
Wiley ID 1676289