For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,2,3,4,5-Pentakis(biphenyl-4-yl) benzene
SpectraBase Compound ID LQTZUepj1kc
InChI InChI=1S/C66H46/c1-6-16-47(17-7-1)52-26-36-57(37-27-52)62-46-63(58-38-28-53(29-39-58)48-18-8-2-9-19-48)65(60-42-32-55(33-43-60)50-22-12-4-13-23-50)66(61-44-34-56(35-45-61)51-24-14-5-15-25-51)64(62)59-40-30-54(31-41-59)49-20-10-3-11-21-49/h1-46H
InChIKey PSNXIHWSDOPEPQ-UHFFFAOYSA-N
Mol Weight 839.1 g/mol
Molecular Formula C66H46
Exact Mass 838.359951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EIHNFQr4ZIY
Name 1,2,3,4,5-Pentakis(biphenyl-4-yl) benzene
Alternate Name(s) 3'',4'',5''-tri([1,1'-biphenyl]-4-yl)-1,1':4',1'':2'',1''':4''',1''''-quinquephenyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C66H46
InChI InChI=1S/C66H46/c1-6-16-47(17-7-1)52-26-36-57(37-27-52)62-46-63(58-38-28-53(29-39-58)48-18-8-2-9-19-48)65(60-42-32-55(33-43-60)50-22-12-4-13-23-50)66(61-44-34-56(35-45-61)51-24-14-5-15-25-51)64(62)59-40-30-54(31-41-59)49-20-10-3-11-21-49/h1-46H
InChIKey PSNXIHWSDOPEPQ-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.tet.2016.01.010
Molecular Weight 839.094 g/mol
SMILES c1(c(c(c(c(c1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1
SPLASH splash10-000i-0000000090-8610295ac44a34159ef0
Source of Spectrum F-72-1090-2f
Wiley ID 1806109