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rac-2-(3-Oxobutyl)-2-butyrylcyclohexanone
SpectraBase Compound ID DJu42Lwc1UP
InChI InChI=1S/C14H22O3/c1-3-6-12(16)14(10-8-11(2)15)9-5-4-7-13(14)17/h3-10H2,1-2H3
InChIKey SNRVUFZAECGPCJ-UHFFFAOYSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lnVHgYzNYo
Name rac-2-(3-Oxobutyl)-2-butyrylcyclohexanone
Alternate Name(s) 2-Butyryl-2-(3-oxobutyl)cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-3-6-12(16)14(10-8-11(2)15)9-5-4-7-13(14)17/h3-10H2,1-2H3
InChIKey SNRVUFZAECGPCJ-UHFFFAOYSA-N
Molecular Weight 238.327 g/mol
SMILES C1(C(=O)CCCC1)(CCC(=O)C)C(=O)CCC
SPLASH splash10-0j6s-5900000000-2371d6580558c1032162
Source of Spectrum QE-11-2665-7
Wiley ID 1638715