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

*Links on SpectraBase are not permalinks.
r-2,c-3-Dimethyl-t-4-benzoyl-t-5-t-butylcyclohexanone
SpectraBase Compound ID ChDQ8OSsVD2
InChI InChI=1S/C19H26O2/c1-12-13(2)17(15(11-16(12)20)19(3,4)5)18(21)14-9-7-6-8-10-14/h6-10,12-13,15,17H,11H2,1-5H3/t12-,13+,15+,17-/m1/s1
InChIKey NSNZHKMRNHGDED-RPCCPQHDSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H26O2
Exact Mass 286.19328 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 9wN1erKSGNe
Name r-2,c-3-Dimethyl-t-4-benzoyl-t-5-t-butylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O2
InChI InChI=1S/C19H26O2/c1-12-13(2)17(15(11-16(12)20)19(3,4)5)18(21)14-9-7-6-8-10-14/h6-10,12-13,15,17H,11H2,1-5H3/t12-,13+,15+,17-/m1/s1
InChIKey NSNZHKMRNHGDED-RPCCPQHDSA-N
Molecular Weight 286.415 g/mol
SMILES [C@]1([C@](CC([C@@]([C@@]1(C)[H])(C)[H])=O)(C(C)(C)C)[H])(C(=O)c1ccccc1)[H]
SPLASH splash10-05i0-2930000000-ae1b856dc309117bf75b
Source of Spectrum AJ-64-3000-9
Synonyms (2R,3S,4R,5S)-4-benzoyl-5-tert-butyl-2,3-dimethylcyclohexanone
Wiley ID 1290299