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Cyclohexanone, 2-butyl-6-methyl-, trans-
SpectraBase Compound ID H7tVVCPz4c7
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-/m1/s1
InChIKey BJQCZCARVYHHOV-NXEZZACHSA-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 Jo2bhosRVx9
Name Cyclohexanone, 2-butyl-6-methyl-, trans-
Alternate Name(s) (2R,6R)-2-butyl-6-methylcyclohexanone trans-2-n-butyl-6-methylcyclohexanone
CAS Registry Number 50299-71-3
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-/m1/s1
InChIKey BJQCZCARVYHHOV-NXEZZACHSA-N
Molecular Weight 168.280 g/mol
SMILES C1(=O)[C@@](CCC[C@]1(CCCC)[H])(C)[H]
SPLASH splash10-000i-9200000000-dccb00b3159959ee2078
Source of Spectrum C-97-112-0
Wiley ID 1165173