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

*Links on SpectraBase are not permalinks.
5-(3,6-Di-t-butyl-1-azulenyl)-5H-dibenzo[a,d]cycloheptene
SpectraBase Compound ID LCJt3zswUY9
InChI InChI=1S/C33H34/c1-32(2,3)24-17-19-27-28(20-18-24)30(33(4,5)6)21-29(27)31-25-13-9-7-11-22(25)15-16-23-12-8-10-14-26(23)31/h7-21,31H,1-6H3
InChIKey PQHADOVKNKQELT-UHFFFAOYSA-N
Mol Weight 430.6 g/mol
Molecular Formula C33H34
Exact Mass 430.266051 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 9ErTqRS96MS
Name 5-(3,6-Di-t-butyl-1-azulenyl)-5H-dibenzo[a,d]cycloheptene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H34
InChI InChI=1S/C33H34/c1-32(2,3)24-17-19-27-28(20-18-24)30(33(4,5)6)21-29(27)31-25-13-9-7-11-22(25)15-16-23-12-8-10-14-26(23)31/h7-21,31H,1-6H3
InChIKey PQHADOVKNKQELT-UHFFFAOYSA-N
Molecular Weight 430.635 g/mol
SMILES c12c(C(c3c(C=C2)cccc3)c2cc(c3ccc(ccc23)C(C)(C)C)C(C)(C)C)cccc1
SPLASH splash10-00lr-0000900000-308c6103b475b12c94eb
Source of Spectrum HC-78-2063-19
Synonyms 5-(3,6-ditert-butyl-1-azulenyl)-5H-dibenzo[a,d]cycloheptene
Wiley ID 1612762