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

*Links on SpectraBase are not permalinks.
IJDSUFQMYUARCQ-ROUUACIJSA-N
SpectraBase Compound ID LaRVCuQX310
InChI InChI=1S/C18H28O2/c1-15(2)6-12-7-17(5)9-16(3,4)10-18(20,11-17)14(12)13(19)8-15/h20H,6-11H2,1-5H3/t17-,18-/m0/s1
InChIKey IJDSUFQMYUARCQ-ROUUACIJSA-N
Mol Weight 276.42 g/mol
Molecular Formula C18H28O2
Exact Mass 276.20893 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 B37YyWlhTZk
Name 5,9-Methanobenzocycloocten-4(1H)-one, 2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-
CAS Registry Number 6244-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-15(2)6-12-7-17(5)9-16(3,4)10-18(20,11-17)14(12)13(19)8-15/h20H,6-11H2,1-5H3/t17-,18-/m0/s1
InChIKey IJDSUFQMYUARCQ-ROUUACIJSA-N
Molecular Weight 276.420 g/mol
SMILES O[C@@]12C3=C(CC(C)(CC3=O)C)C[C@@](CC(C1)(C)C)(C2)C
SPLASH splash10-0a4i-1390000000-2b6f55ee2970638d3c51
Source of Spectrum T-67-3654-0
Synonyms Diisophorone Isophorone dimer
Wiley ID 40335