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

*Links on SpectraBase are not permalinks.

5,5-DIMETHYL-2-(2'-OXO-PROPYL)-CYCLOHEXA-1,3-DIONE

View entire compound with spectra: 3 NMR, and 1 MS (GC)

5,5-DIMETHYL-2-(2'-OXO-PROPYL)-CYCLOHEXA-1,3-DIONE
SpectraBase Compound ID 71KatRflPai
InChI InChI=1S/C11H16O3/c1-7(12)4-8-9(13)5-11(2,3)6-10(8)14/h8H,4-6H2,1-3H3
InChIKey AIZYSTCNHMEEQO-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IYkI29OFt5h
Name 2-Acetonyl-5,5-dimethyl-cyclohexane-1,3-dione keto form
CAS Registry Number 13148-87-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-7(12)4-8-9(13)5-11(2,3)6-10(8)14/h8H,4-6H2,1-3H3
InChIKey AIZYSTCNHMEEQO-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference M.P. Sammes, P.M. Maini, Magn. Res. Chem. 25, 372 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3