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

*Links on SpectraBase are not permalinks.
1H-2-Benzoxocin-1-one, 3,4,5,6-tetraphenyl-
SpectraBase Compound ID 9UL3f7EJKOr
InChI InChI=1S/C35H24O2/c36-35-30-24-14-13-23-29(30)31(25-15-5-1-6-16-25)32(26-17-7-2-8-18-26)33(27-19-9-3-10-20-27)34(37-35)28-21-11-4-12-22-28/h1-24H/b32-31-,34-33-
InChIKey IXUXHMMUGSZCIP-NELHQWCOSA-N
Mol Weight 476.6 g/mol
Molecular Formula C35H24O2
Exact Mass 476.17763 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 BYrdq8eD0q4
Name 1H-2-Benzoxocin-1-one, 3,4,5,6-tetraphenyl-
CAS Registry Number 106976-77-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H24O2
InChI InChI=1S/C35H24O2/c36-35-30-24-14-13-23-29(30)31(25-15-5-1-6-16-25)32(26-17-7-2-8-18-26)33(27-19-9-3-10-20-27)34(37-35)28-21-11-4-12-22-28/h1-24H/b32-31-,34-33-
InChIKey IXUXHMMUGSZCIP-NELHQWCOSA-N
Molecular Weight 476.575 g/mol
SMILES c12\C(=C/(\C(=C\(OC(c1cccc2)=O)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-0a4i-0900100000-468816ff2c4520fcbd7b
Source of Spectrum J-52-1088-4
Synonyms 3,4,5,6-tetraphenyl-1H-2-benzoxocin-1-one 3-Oxa-4,5,6,7-tetraphenyl-bicyclo[6.4.0]dodecan-4,6,9,11,8(1)pentaen-2-one
Wiley ID 1394471