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Cyclohexanone, 2-butyl-6-methyl-, cis-
SpectraBase Compound ID HO8wpNCiqJB
InChI InChI=1S/C11H20O/c1-3-4-7-10-8-5-6-9(2)11(10)12/h9-10H,3-8H2,1-2H3/t9-,10+/m0/s1
InChIKey BJQCZCARVYHHOV-VHSXEESVSA-N
Mol Weight 168.28 g/mol
Molecular Formula C11H20O
Exact Mass 168.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5IRXl1tW22e
Name Cyclohexanone, 2-butyl-6-methyl-, cis-
Alternate Name(s) (2R,6S)-2-butyl-6-methylcyclohexanone cis-2-n-butyl-6-methylcyclohexanone
CAS Registry Number 50299-69-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O
InChI InChI=1S/C11H20O/c1-3-4-7-10-8-5-6-9(2)11(10)12/h9-10H,3-8H2,1-2H3/t9-,10+/m0/s1
InChIKey BJQCZCARVYHHOV-VHSXEESVSA-N
Molecular Weight 168.280 g/mol
SMILES C1(=O)[C@](CCC[C@]1(CCCC)[H])(C)[H]
SPLASH splash10-03dj-3900000000-35ecbb62b9a74e79ede3
Source of Spectrum C-97-112-0
Wiley ID 1165172