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

*Links on SpectraBase are not permalinks.
Cyclohexanone, 3,3'-(2-oxo-1-phenyl-1,3-propanediyl)bis-
SpectraBase Compound ID C9PtB0ahiHM
InChI InChI=1S/C21H26O3/c22-18-10-4-6-15(12-18)13-20(24)21(16-7-2-1-3-8-16)17-9-5-11-19(23)14-17/h1-3,7-8,15,17,21H,4-6,9-14H2
InChIKey XWXATXVFKVZVLK-UHFFFAOYSA-N
Mol Weight 326.44 g/mol
Molecular Formula C21H26O3
Exact Mass 326.188195 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 4oBAM3Zrn3p
Name Cyclohexanone, 3,3'-(2-oxo-1-phenyl-1,3-propanediyl)bis-
Alternate Name(s) 3,3'-(2-oxo-1-phenyl-1,3-propanediyl)biscyclohexanone 3-[2-oxo-3-(3-oxocyclohexyl)-1-phenylpropyl]cyclohexanone
CAS Registry Number 81408-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O3
InChI InChI=1S/C21H26O3/c22-18-10-4-6-15(12-18)13-20(24)21(16-7-2-1-3-8-16)17-9-5-11-19(23)14-17/h1-3,7-8,15,17,21H,4-6,9-14H2
InChIKey XWXATXVFKVZVLK-UHFFFAOYSA-N
Molecular Weight 326.436 g/mol
SMILES C(C(C1CC(=O)CCC1)c1ccccc1)(CC1CC(=O)CCC1)=O
SPLASH splash10-052e-9200000000-528d63076883bf4b6a51
Source of Spectrum J-47-2417-0
Wiley ID 1325098