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1-[(1R,2R,3S,4R)-3-(2-Hydroxyethyl)-2,4-dimethylcyclohexyl]ethanone
SpectraBase Compound ID IoZjILvci66
InChI InChI=1S/C12H22O2/c1-8-4-5-12(10(3)14)9(2)11(8)6-7-13/h8-9,11-13H,4-7H2,1-3H3/t8-,9-,11+,12-/m1/s1
InChIKey MYOWJHHBSPQESY-PKZYVASSSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHUHHNoZYfk
Name 1-[(1R,2R,3S,4R)-3-(2-Hydroxyethyl)-2,4-dimethylcyclohexyl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-8-4-5-12(10(3)14)9(2)11(8)6-7-13/h8-9,11-13H,4-7H2,1-3H3/t8-,9-,11+,12-/m1/s1
InChIKey MYOWJHHBSPQESY-PKZYVASSSA-N
Molecular Weight 198.306 g/mol
SMILES OCC[C@@]1([C@]([C@@](CC[C@]1(C)[H])(C(=O)C)[H])(C)[H])[H]
SPLASH splash10-00l7-9200000000-f51d61bd8d8463022982
Source of Spectrum QE-7-529-16
Synonyms 1-[(1R,2R,3S,4R)-3-(2-Hydroxyethyl)-2,4-dimethylcyclohexyl]ethone 1-[(1R,2R,3S,6R)-3-(2-Hydroxyethyl)-2,4-dimethylcyclohexyl]ethone
Wiley ID 1557009