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Tetraphenylcyclopentadienylbromide
SpectraBase Compound ID LYjVlJsnHOc
InChI InChI=1S/C29H21Br/c30-29-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)28(29)24-19-11-4-12-20-24/h1-20,27H
InChIKey MQVHXHYQGXNIMR-UHFFFAOYSA-N
Mol Weight 449.39 g/mol
Molecular Formula C29H21Br
Exact Mass 448.082664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gsfGhjPXib
Name Tetraphenylcyclopentadienylbromide
CAS Registry Number 33924-69-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H21Br
InChI InChI=1S/C29H21Br/c30-29-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)28(29)24-19-11-4-12-20-24/h1-20,27H
InChIKey MQVHXHYQGXNIMR-UHFFFAOYSA-N
Molecular Weight 449.391 g/mol
SMILES C=1(C(=C(Br)C(C1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-014i-0009500000-f87bd39fac126b9732bf
Source of Spectrum K-121-216-8
Synonyms (2-bromo-3,4,5-triphenyl-1,4-cyclopentadien-1-yl)benzene
Wiley ID 1387338