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5-Bromo-1-((5-(4-methylbenzyl)-1-phenyl-1H-pyrazol-3-yl)-methyl)-1H-indole
SpectraBase Compound ID 8O5AF7wKjH3
InChI InChI=1S/C26H22BrN3/c1-19-7-9-20(10-8-19)15-25-17-23(28-30(25)24-5-3-2-4-6-24)18-29-14-13-21-16-22(27)11-12-26(21)29/h2-14,16-17H,15,18H2,1H3
InChIKey VOQZAKVUMONTHH-UHFFFAOYSA-N
Mol Weight 456.39 g/mol
Molecular Formula C26H22BrN3
Exact Mass 455.099711 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBIQlRRzqWa
Name 5-Bromo-1-((5-(4-methylbenzyl)-1-phenyl-1H-pyrazol-3-yl)-methyl)-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H22BrN3
InChI InChI=1S/C26H22BrN3/c1-19-7-9-20(10-8-19)15-25-17-23(28-30(25)24-5-3-2-4-6-24)18-29-14-13-21-16-22(27)11-12-26(21)29/h2-14,16-17H,15,18H2,1H3
InChIKey VOQZAKVUMONTHH-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4ra16439c
Molecular Weight 456.387 g/mol
SMILES c1c([n](nc1C[n]1ccc2c1ccc(c2)Br)-c1ccccc1)Cc1ccc(cc1)C
SPLASH splash10-08fr-2290500000-c22c0405e164e29c791d
Source of Spectrum RSA-5-21122-6f
Synonyms 5-Bromo-1-((5-(4-methylbenzyl)-1-phenyl-1H-pyrazol-3-yl)methyl)-1H-indole
Wiley ID 1761038