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3-METHYL-5-(2',2',6'-TRIMETHYL-6'-HYDROXYCYCLOHEXYL)-PENTANOIC-ACID
SpectraBase Compound ID CIyzZDiRELe
InChI InChI=1S/C15H28O3/c1-11(10-13(16)17)6-7-12-14(2,3)8-5-9-15(12,4)18/h11-12,18H,5-10H2,1-4H3,(H,16,17)/t11?,12?,15-/m1/s1
InChIKey XHIZLLMJEWQQGF-KOHJWAIASA-N
Mol Weight 256.39 g/mol
Molecular Formula C15H28O3
Exact Mass 256.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GquY7BwSIOL
Name 3-METHYL-5-(2',2',6'-TRIMETHYL-6'-HYDROXYCYCLOHEXYL)-PENTANOIC-ACID
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H28O3
InChI InChI=1S/C15H28O3/c1-11(10-13(16)17)6-7-12-14(2,3)8-5-9-15(12,4)18/h11-12,18H,5-10H2,1-4H3,(H,16,17)/t11?,12?,15-/m1/s1
InChIKey XHIZLLMJEWQQGF-KOHJWAIASA-N
Literature Reference Author A.C.PINTO,W.F.BRAGA,C.M.REZENDE,F.M.S.GARRIDO,V.F.VEIGA,L.BE RGTER,M.L.PATITUCCI,
Literature Reference Citation J.BRAZ.CHEM.SOC.,11,355(2000)
Literature Reference DOI 10.1590/s0103-50532000000400005
Molecular Weight 256.386 g/mol
Solvent CDCl3
Source File Reference UWMS5676