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1,2,4,5-Tetrakis(4-phenylphenyl)benzene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1,2,4,5-Tetrakis(4-phenylphenyl)benzene
SpectraBase Compound ID A5ut2nAehe9
InChI InChI=1S/C54H38/c1-5-13-39(14-6-1)43-21-29-47(30-22-43)51-37-53(49-33-25-45(26-34-49)41-17-9-3-10-18-41)54(50-35-27-46(28-36-50)42-19-11-4-12-20-42)38-52(51)48-31-23-44(24-32-48)40-15-7-2-8-16-40/h1-38H
InChIKey HWUOQFPHJXANEL-UHFFFAOYSA-N
Mol Weight 686.9 g/mol
Molecular Formula C54H38
Exact Mass 686.297351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5nMr218EQUC
Name 1,2,4,5-tetrakis(4-phenylphenyl)benzene
CAS Registry Number 99397-82-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H38
InChI InChI=1S/C54H38/c1-5-13-39(14-6-1)43-21-29-47(30-22-43)51-37-53(49-33-25-45(26-34-49)41-17-9-3-10-18-41)54(50-35-27-46(28-36-50)42-19-11-4-12-20-42)38-52(51)48-31-23-44(24-32-48)40-15-7-2-8-16-40/h1-38H
InChIKey HWUOQFPHJXANEL-UHFFFAOYSA-N
Molecular Weight 686.898 g/mol
SMILES c1(c(cc(c(c1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1
SPLASH splash10-0006-9000002000-cb92783b6a6dbd5c6892
Source of Spectrum J-50-5528-18
Wiley ID 1414576