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(2S,3R,6S)-6-[2-(benzyloxy)-1-methyl-ethyl]-2-(3-ketobutyl)-3-methyl-cyclohexan-1-one
SpectraBase Compound ID 2NcawS2UHlP
InChI InChI=1S/C21H30O3/c1-15-9-11-20(21(23)19(15)12-10-17(3)22)16(2)13-24-14-18-7-5-4-6-8-18/h4-8,15-16,19-20H,9-14H2,1-3H3/t15-,16?,19+,20+/m1/s1
InChIKey YIFBIVSJRLJJSZ-IUEOMJKZSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRyZI3uOZ8y
Name (2S,3R,6S)-6-[2-(benzyloxy)-1-methyl-ethyl]-2-(3-ketobutyl)-3-methyl-cyclohexan-1-one
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-15-9-11-20(21(23)19(15)12-10-17(3)22)16(2)13-24-14-18-7-5-4-6-8-18/h4-8,15-16,19-20H,9-14H2,1-3H3/t15-,16?,19+,20+/m1/s1
InChIKey YIFBIVSJRLJJSZ-IUEOMJKZSA-N
Literature Reference Author S.M.HUI,K.S.NGO,G.D.BROWN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3435(1997)
Literature Reference DOI 10.1039/a702714a
Molecular Weight 330.467 g/mol
Solvent CDCl3
Source File Reference UWRU8045