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(1R)-3-OXO-4,6,6-TRIMETHYL-CYCLOHEX-4-ENE-1-CARBOXYLIC-ACID
SpectraBase Compound ID 3lQm9pmQWYL
InChI InChI=1S/C10H14O3/c1-6-5-10(2,3)7(9(12)13)4-8(6)11/h5,7H,4H2,1-3H3,(H,12,13)/t7-/m0/s1
InChIKey KFKGGMRELGBRAF-ZETCQYMHSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6QWy0qdYEwn
Name (1R)-3-OXO-4,6,6-TRIMETHYL-CYCLOHEX-4-ENE-1-CARBOXYLIC-ACID
Compound Number 18
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-6-5-10(2,3)7(9(12)13)4-8(6)11/h5,7H,4H2,1-3H3,(H,12,13)/t7-/m0/s1
InChIKey KFKGGMRELGBRAF-ZETCQYMHSA-N
Literature Reference Author J.A.MARCO,J.F.SANZ,A.YUSTE,M.CARDA,J.JAKUPOVIC
Literature Reference Citation PHYTOCHEM.,30,3661(1991)
Literature Reference DOI 10.1016/0031-9422(91)80088-I
Molecular Weight 182.219 g/mol
Solvent CDCl3
Source File Reference UWMS27011