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

*Links on SpectraBase are not permalinks.
Benzocyclooctene, 6-methyl-7,8,9-triphenyl-
SpectraBase Compound ID AjvgSP8GdDa
InChI InChI=1S/C31H24/c1-23-21-27-19-11-12-20-28(27)22-29(24-13-5-2-6-14-24)31(26-17-9-4-10-18-26)30(23)25-15-7-3-8-16-25/h2-22H,1H3/b23-21-,27-21-,28-22-,29-22-,30-23-,31-29+,31-30+
InChIKey YWYKAZOQCVQCOO-LSNHUKDOSA-N
Mol Weight 396.53 g/mol
Molecular Formula C31H24
Exact Mass 396.187801 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 Jx937beteQn
Name Benzocyclooctene, 6-methyl-7,8,9-triphenyl-
CAS Registry Number 107319-74-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H24
InChI InChI=1S/C31H24/c1-23-21-27-19-11-12-20-28(27)22-29(24-13-5-2-6-14-24)31(26-17-9-4-10-18-26)30(23)25-15-7-3-8-16-25/h2-22H,1H3/b23-21-,27-21-,28-22-,29-22-,30-23-,31-29+,31-30+
InChIKey YWYKAZOQCVQCOO-LSNHUKDOSA-N
Molecular Weight 396.533 g/mol
SMILES c12\C=C/(\C(=C/(\C(=C/c1cccc2)C)c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-0002-0019000000-eb08884f72bac087dce4
Source of Spectrum KC-1986-965-19
Synonyms 6-Methyl-7,8,9-triphenylbenzocyclo-octene 6-methyl-7,8,9-triphenylbenzo[a]cyclooctene
Wiley ID 1367829