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2,2-Dihydroxy-4,6,6-trimethyl-cyclohex-4-ene-1,3-dione

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2,2-Dihydroxy-4,6,6-trimethyl-cyclohex-4-ene-1,3-dione
SpectraBase Compound ID 8Ma9LrKILx2
InChI InChI=1S/C9H12O4/c1-5-4-8(2,3)7(11)9(12,13)6(5)10/h4,12-13H,1-3H3
InChIKey WNTXTZOZVZMPTM-UHFFFAOYSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I8TmSrCE7AY
Name 2,2-Dihydroxy-4,6,6-trimethyl-cyclohex-4-ene-1,3-dione
CAS Registry Number 114198-66-2
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-5-4-8(2,3)7(11)9(12,13)6(5)10/h4,12-13H,1-3H3
InChIKey WNTXTZOZVZMPTM-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference J. Detering, H.D. Martin, Angew. Chem. 100, 714 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3