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3-(12-HYDROXYDODECYL)-2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE
SpectraBase Compound ID KdFU9VRsq0t
InChI InChI=1S/C21H38O2/c1-18-19(21(2,3)16-15-20(18)23)14-12-10-8-6-4-5-7-9-11-13-17-22/h22H,4-17H2,1-3H3
InChIKey UNNNLVVXTUETAT-UHFFFAOYSA-N
Mol Weight 322.5 g/mol
Molecular Formula C21H38O2
Exact Mass 322.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IFVHktPl0rA
Name 3-(12-HYDROXYDODECYL)-2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H38O2
InChI InChI=1S/C21H38O2/c1-18-19(21(2,3)16-15-20(18)23)14-12-10-8-6-4-5-7-9-11-13-17-22/h22H,4-17H2,1-3H3
InChIKey UNNNLVVXTUETAT-UHFFFAOYSA-N
Literature Reference Author B.LUU,J.L.G.D.AGUILAR,C.GIRLANDA-JUNGES
Literature Reference Citation MOLECULES,5,1439(2000)
Literature Reference DOI 10.3390/51201439
Molecular Weight 322.532 g/mol
Solvent CDCl3
Source File Reference UWVN7335