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4-chloro-1-(3-fluorophenyl)-3,5-bis(4-methylphenyl)-1H-pyrazole

View entire compound with spectra: 2 NMR

4-chloro-1-(3-fluorophenyl)-3,5-bis(4-methylphenyl)-1H-pyrazole
SpectraBase Compound ID BgcuU2efGqH
InChI InChI=1S/C23H18ClFN2/c1-15-6-10-17(11-7-15)22-21(24)23(18-12-8-16(2)9-13-18)27(26-22)20-5-3-4-19(25)14-20/h3-14H,1-2H3
InChIKey YLMWLBMFJQGJJO-UHFFFAOYSA-N
Mol Weight 376.86 g/mol
Molecular Formula C23H18ClFN2
Exact Mass 376.114254 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LeTqw29mtE0
Name 4-Chloro-1-(3-fluorophenyl)-3,5-bis(4-methylphenyl)-1H-pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 376.114254451 u
Formula C23H18ClFN2
InChI InChI=1S/C23H18ClFN2/c1-15-6-10-17(11-7-15)22-21(24)23(18-12-8-16(2)9-13-18)27(26-22)20-5-3-4-19(25)14-20/h3-14H,1-2H3
InChIKey YLMWLBMFJQGJJO-UHFFFAOYSA-N
Molecular Weight 376.862 g/mol
SMILES C=1C(=CC(=CC1)N1C(=C(Cl)C(=N1)C=1C=CC(=CC1)C)C1=CC=C(C)C=C1)F