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

View entire compound with spectra: 2 NMR

3,5-bis(4-bromophenyl)-4-methyl-1-(4-methylphenyl)-1H-pyrazole
SpectraBase Compound ID B7BBdg36mqO
InChI InChI=1S/C23H18Br2N2/c1-15-3-13-21(14-4-15)27-23(18-7-11-20(25)12-8-18)16(2)22(26-27)17-5-9-19(24)10-6-17/h3-14H,1-2H3
InChIKey BWHJUXOYQQEKOD-UHFFFAOYSA-N
Mol Weight 482.22 g/mol
Molecular Formula C23H18Br2N2
Exact Mass 479.983675 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A3ozp0KeRFD
Name 3,5-bis(4-Bromophenyl)-4-methyl-1-(4-methylphenyl)-1H-pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 479.983674588 u
Formula C23H18Br2N2
InChI InChI=1S/C23H18Br2N2/c1-15-3-13-21(14-4-15)27-23(18-7-11-20(25)12-8-18)16(2)22(26-27)17-5-9-19(24)10-6-17/h3-14H,1-2H3
InChIKey BWHJUXOYQQEKOD-UHFFFAOYSA-N
Molecular Weight 482.219 g/mol
SMILES CC=1C=CC(=CC1)N1N=C(C2=CC=C(C=C2)Br)C(=C1C=1C=CC(Br)=CC1)C