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3,5-bis(4-bromophenyl)-1-(3-fluorobenzyl)-4-methyl-1H-pyrazole

View entire compound with spectra: 2 NMR

3,5-bis(4-bromophenyl)-1-(3-fluorobenzyl)-4-methyl-1H-pyrazole
SpectraBase Compound ID 6uOUBxGahMp
InChI InChI=1S/C23H17Br2FN2/c1-15-22(17-5-9-19(24)10-6-17)27-28(14-16-3-2-4-21(26)13-16)23(15)18-7-11-20(25)12-8-18/h2-13H,14H2,1H3
InChIKey WSDKEHBJCUNWPM-UHFFFAOYSA-N
Mol Weight 500.21 g/mol
Molecular Formula C23H17Br2FN2
Exact Mass 497.974253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DWrVW3L1Ywr
Name 3,5-bis(4-Bromophenyl)-1-(3-fluorobenzyl)-4-methyl-1H-pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 497.974252718 u
Formula C23H17Br2FN2
InChI InChI=1S/C23H17Br2FN2/c1-15-22(17-5-9-19(24)10-6-17)27-28(14-16-3-2-4-21(26)13-16)23(15)18-7-11-20(25)12-8-18/h2-13H,14H2,1H3
InChIKey WSDKEHBJCUNWPM-UHFFFAOYSA-N
Molecular Weight 500.209 g/mol
SMILES C=1C=CC(F)=CC1CN1N=C(C2=CC=C(C=C2)Br)C(=C1C=1C=CC(Br)=CC1)C