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1,3-Cyclohexanedione, 2,5,5-trimethyl-
SpectraBase Compound ID 30fhlHGoexS
InChI InChI=1S/C9H14O2/c1-6-7(10)4-9(2,3)5-8(6)11/h6H,4-5H2,1-3H3
InChIKey WJTGLPHMQKJRIX-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5BXwpY8W7CK
Name 2,5,5-Trimethyl-cyclohexane-1,3-dione
CAS Registry Number 1125-11-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-6-7(10)4-9(2,3)5-8(6)11/h6H,4-5H2,1-3H3
InChIKey WJTGLPHMQKJRIX-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference F. Imashiro, S. Maeda, K. Takegoshi, J. Am. Chem. Soc. 109, 5213 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6