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3(R)-3-Isopropenyl-5-propyl-6-methylcyclohexanone
SpectraBase Compound ID Euw9iZumHMn
InChI InChI=1S/C13H22O/c1-5-6-11-7-12(9(2)3)8-13(14)10(11)4/h10-12H,2,5-8H2,1,3-4H3/t10?,11?,12-/m1/s1
InChIKey QIAYCABFMZYOKL-HTAVTVPLSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxnoclkEzWx
Name 3(R)-3-Isopropenyl-5-propyl-6-methylcyclohexanone
Alternate Name(s) (5R)-5-isopropenyl-2-methyl-3-propylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-5-6-11-7-12(9(2)3)8-13(14)10(11)4/h10-12H,2,5-8H2,1,3-4H3/t10?,11?,12-/m1/s1
InChIKey QIAYCABFMZYOKL-HTAVTVPLSA-N
Molecular Weight 194.318 g/mol
SMILES C1(C[C@](C(=C)C)(CC(C1C)CCC)[H])=O
SPLASH splash10-01ot-7900000000-49e2777f9169d6210370
Source of Spectrum F-51-750-9
Wiley ID 790569