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3-METHYL-5-(2,2,6-TRIMETHYL-6-HYDROXY-1-CYClOHEXYL)-PENTANOIC-ACID
SpectraBase Compound ID L0IAclQV0O8
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-AADWAWOOSA-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 7BgHyIutSzF
Name 3-METHYL-5-(2,2,6-TRIMETHYL-6-HYDROXY-1-CYClOHEXYL)-PENTANOIC-ACID
Compound Number 1
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-AADWAWOOSA-N
Literature Reference Author W.F.BRAGA,C.M.REZENDE,O.A.C.ANTUNES,A.C.PINTO
Literature Reference Citation PHYTOCHEM.,49,263(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00899-6
Molecular Weight 256.386 g/mol
Solvent CDCl3
Source File Reference UWLU122