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2-(3,5-DIOXO-4-ISOPROPYL-PHENYL)-2,6,6-TRIMETHYL-CYCLOHEXYL-ETHANOIC-ACID
SpectraBase Compound ID JII7pyqX1Sm
InChI InChI=1S/C20H28O4/c1-12(2)13-9-16(22)14(10-15(13)21)20(5)8-6-7-19(3,4)17(20)11-18(23)24/h9-10,12,17H,6-8,11H2,1-5H3,(H,23,24)/t17?,20-/m0/s1
InChIKey RXKYDRDAPCHXPT-OZBJMMHXSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HXq8xF7PV3M
Name 2-(3,5-DIOXO-4-ISOPROPYL-PHENYL)-2,6,6-TRIMETHYL-CYCLOHEXYL-ETHANOIC-ACID
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-12(2)13-9-16(22)14(10-15(13)21)20(5)8-6-7-19(3,4)17(20)11-18(23)24/h9-10,12,17H,6-8,11H2,1-5H3,(H,23,24)/t17?,20-/m0/s1
InChIKey RXKYDRDAPCHXPT-OZBJMMHXSA-N
Literature Reference Author R.H.BURNELL,M.JEAN,D.POIRIER,S.SAVARD
Literature Reference Citation CAN.J.CHEM.,62,2822(1984)
Literature Reference DOI 10.1139/v84-478
Molecular Weight 332.440 g/mol
Solvent CDCl3
Source File Reference UWED2314