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1,3-Cyclopentadiene, 5-bromo-1,2,4,5-tetraphenyl-3-p-tolyl-
SpectraBase Compound ID HJEo50CwF29
InChI InChI=1S/C36H27Br/c1-26-22-24-28(25-23-26)33-32(27-14-6-2-7-15-27)34(29-16-8-3-9-17-29)36(37,31-20-12-5-13-21-31)35(33)30-18-10-4-11-19-30/h2-25H,1H3
InChIKey WLMMVNRDAUQRFQ-UHFFFAOYSA-N
Mol Weight 539.5 g/mol
Molecular Formula C36H27Br
Exact Mass 538.129614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73BYFvfA9Jj
Name 1,3-Cyclopentadiene, 5-bromo-1,2,4,5-tetraphenyl-3-p-tolyl-
CAS Registry Number 19057-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H27Br
InChI InChI=1S/C36H27Br/c1-26-22-24-28(25-23-26)33-32(27-14-6-2-7-15-27)34(29-16-8-3-9-17-29)36(37,31-20-12-5-13-21-31)35(33)30-18-10-4-11-19-30/h2-25H,1H3
InChIKey WLMMVNRDAUQRFQ-UHFFFAOYSA-N
Molecular Weight 539.516 g/mol
SMILES C1(C(=C(c2ccc(cc2)C)C(=C1c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)Br
SPLASH splash10-08fr-0212900000-ba38f0d748e8c9b48402
Source of Spectrum B-43-287-2
Synonyms Benzene, 1-(3-bromo-2,3,4,5-tetraphenyl-1,4-cyclopentadien-1-yl)-4-methyl- 1-(3-bromo-2,3,4,5-tetraphenyl-1,4-cyclopentadien-1-yl)-4-methylbenzene 1-Bromo-2,3,4,5-tetraphenyl(p-tolyl)cyclopenta-2,4-diene
Wiley ID 1404413