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

*Links on SpectraBase are not permalinks.
6-(1',1"-Biphenyl-4'-yl)-1,4,8-trimethylazulene
SpectraBase Compound ID Ach5zdFa0Ks
InChI InChI=1S/C25H22/c1-17-9-14-24-18(2)15-23(16-19(3)25(17)24)22-12-10-21(11-13-22)20-7-5-4-6-8-20/h4-16H,1-3H3
InChIKey XDWQDYRHOBAEQI-UHFFFAOYSA-N
Mol Weight 322.45 g/mol
Molecular Formula C25H22
Exact Mass 322.172151 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 7TJdBeCvAo8
Name 6-(1',1"-Biphenyl-4'-yl)-1,4,8-trimethylazulene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22
InChI InChI=1S/C25H22/c1-17-9-14-24-18(2)15-23(16-19(3)25(17)24)22-12-10-21(11-13-22)20-7-5-4-6-8-20/h4-16H,1-3H3
InChIKey XDWQDYRHOBAEQI-UHFFFAOYSA-N
Molecular Weight 322.451 g/mol
SMILES c12c(c(cc(cc2C)-c2ccc(cc2)-c2ccccc2)C)c(C)cc1
SPLASH splash10-00di-0009000000-94dd5a9993cded975b64
Source of Spectrum H-85-50-1
Synonyms 6-[1,1'-biphenyl]-4-yl-1,4,8-trimethylazulene
Wiley ID 1523933