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3-([1,1'-Biphenyl]-4-yl)-4-(1-(4-bromophenyl)-4,5-diphenyl-1H-imidazol-2-yl)-1-phenyl-1H-pyrazole
SpectraBase Compound ID FfqqMPzSV6N
InChI InChI=1S/C42H29BrN4/c43-35-25-27-37(28-26-35)47-41(34-17-9-3-10-18-34)40(32-15-7-2-8-16-32)44-42(47)38-29-46(36-19-11-4-12-20-36)45-39(38)33-23-21-31(22-24-33)30-13-5-1-6-14-30/h1-29H
InChIKey QRMGMTKIVQTKSN-UHFFFAOYSA-N
Mol Weight 669.6 g/mol
Molecular Formula C42H29BrN4
Exact Mass 668.15756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfyC5xBKSTJ
Name 3-([1,1'-Biphenyl]-4-yl)-4-(1-(4-bromophenyl)-4,5-diphenyl-1H-imidazol-2-yl)-1-phenyl-1H-pyrazole
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 668.157559950 u
Formula C42H29BrN4
InChI InChI=1S/C42H29BrN4/c43-35-25-27-37(28-26-35)47-41(34-17-9-3-10-18-34)40(32-15-7-2-8-16-32)44-42(47)38-29-46(36-19-11-4-12-20-36)45-39(38)33-23-21-31(22-24-33)30-13-5-1-6-14-30/h1-29H
InChIKey QRMGMTKIVQTKSN-UHFFFAOYSA-N
Instrument Name DFS-Thermo GC MS
Ionization Type EI Positive ion
Literature Reference DOI 10.1016/j.arabjc.2022.104384
Quality 241
SMILES C1(=CC=C(C=C1)C1=NN(C=C1C=1N(C(=C(N1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=C(C=C1)Br)C1=CC=CC=C1)C1=CC=CC=C1
SPLASH splash10-014i-3211009000-be952fce52f5d09ff2fb
Source of Spectrum AJC-16-SM13-5h (DOI: 10.1016/j.arabjc.2022.104384)
Wiley ID 1911039