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1-Phenyl-5-(trifluoromethyl)-3-(4-(trifluoromethyl)phenyl)-1H-pyrazole

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Phenyl-5-(trifluoromethyl)-3-(4-(trifluoromethyl)phenyl)-1H-pyrazole
SpectraBase Compound ID LaXAU308jGp
InChI InChI=1S/C17H10F6N2/c18-16(19,20)12-8-6-11(7-9-12)14-10-15(17(21,22)23)25(24-14)13-4-2-1-3-5-13/h1-10H
InChIKey AHJPQAQFDHPYPB-UHFFFAOYSA-N
Mol Weight 356.27 g/mol
Molecular Formula C17H10F6N2
Exact Mass 356.074817 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DA9XqiwEJtX
Name 1-Phenyl-5-(trifluoromethyl)-3-(4-(trifluoromethyl)phenyl)-1H-pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.074817308 u
Formula C17H10F6N2
InChI InChI=1S/C17H10F6N2/c18-16(19,20)12-8-6-11(7-9-12)14-10-15(17(21,22)23)25(24-14)13-4-2-1-3-5-13/h1-10H
InChIKey AHJPQAQFDHPYPB-UHFFFAOYSA-N
Molecular Weight 356.271 g/mol
SMILES C1(=NN(C(=C1)C(F)(F)F)C=1C=CC=CC1)C=1C=CC(=CC1)C(F)(F)F