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(+)-(1'S,3'S,6'S,E)-1-(2',2',3',6'-tetramethylcyclohexyl)-hex-1-en-3-one

Compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(+)-(1'S,3'S,6'S,E)-1-(2',2',3',6'-tetramethylcyclohexyl)-hex-1-en-3-one
SpectraBase Compound ID JGw25SIX7uF
InChI InChI=1S/C16H28O/c1-6-7-14(17)10-11-15-12(2)8-9-13(3)16(15,4)5/h10-13,15H,6-9H2,1-5H3/b11-10+/t12-,13-,15+/m0/s1
InChIKey DNMWURVBURMZIA-JPZPJLSBSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol
Enantiomer InChIKey DNMWURVBURMZIA-YGTVFWJQSA-N

View Spectrum of (+)-(1'S,3'S,6'S,E)-1-(2',2',3',6'-tetramethylcyclohexyl)-hex-1-en-3-one

Vapor Phase IR Spectrum
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View Spectrum of (+)-(1'S,3'S,6'S,E)-1-(2',2',3',6'-tetramethylcyclohexyl)-hex-1-en-3-one

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum H-76-2085-21

View Spectrum of (+)-(1'S,3'S,6'S,E)-1-(2',2',3',6'-tetramethylcyclohexyl)-hex-1-en-3-one

13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent Unknown
  • (1'S,3'S,6'S,E)-1-(2',2',3',6'-Tetramethylcyclohexyl)hex-1-en-3-one
  • (1E)-1-[(1S,3S,6S)-2,2,3,6-tetramethylcyclohexyl]-1-hexen-3-one
1-Hexen-3-one, 1-(2,2,3,6-tetramethylcyclohexyl)-, [1.alpha.(E),3.beta.,6.beta.]-
(-)-(1'S,3'S,3E)-4-(2',2',3'-TRIMETHYL-6'-METHYLIDENECYCLOHEX-1'-YL)-BUT-3-EN-2-ONE;((-)-(2S,6S)-TRANS-GAMMA-IRONE)
3e-3'S-gamma.-irone
2-Propenoic acid, 3-(2,2,3-trimethyl-6-methylenecyclohexyl)-, [1.alpha.(E),3.alpha.]-(.+-.)-
(E,2S)-4-[(1R,3R)-2,2,3-trimethyl-6-methylene-cyclohexyl]but-3-en-2-ol
6,6-Dimethyl-bicyclo(2.2.2)oct-2-en-5-endo-ol
6,6-DIMETHYL-BICYCLO-[2.2.2]-OCT-2-EN-5-SYN-OL
FOLIASALACIOL-J;(3S,5R,6R,7E,9R)-MEGASTIGMAN-7-ENE-3,9,10-TRIOL
4-(TRANS-2,5,6,6-TETRAMETHYLCYCLOHEX-2-EN-1-YL)-BUTAN-2-ONE;(TRANS-ALPHA-DIHYDROIRONE)
(1R,3S,E)-2-METHYL-4-(2,2,3-TRIMETHYL-6-METHYLIDENECYCLOHEX-1-YL)-BUT-2-ENAL
Title Journal or Book Year
Preparation of optically active flowery and woody-like odorant ketonesvia Corey-Chaykovsky oxiranylation: Irones and analogues Helvetica Chimica Acta 1993
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Unknown Identification

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