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3-(4-Hydroxybutyl)-2-methylcyclohexanone
SpectraBase Compound ID CcgvikgdTln
InChI InChI=1S/C11H20O2/c1-9-10(5-2-3-8-12)6-4-7-11(9)13/h9-10,12H,2-8H2,1H3
InChIKey YPALGXOOHTYQNN-UHFFFAOYSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzoV2oXUWj6
Name 3-(4-Hydroxybutyl)-2-methylcyclohexanone
Alternate Name(s) 2-Methyl-3-(4-oxidanylbutyl)cyclohexan-1-one 3-(4-hydroxybutyl)-2-methyl-1-cyclohexanone 3-(4-hydroxybutyl)-2-methyl-cyclohexanone 3-(4-hydroxybutyl)-2-methylcyclohexan-1-one Cyclohexanone, 3-(4-hydroxybutyl)-2-methyl-
CAS Registry Number 91212-98-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-9-10(5-2-3-8-12)6-4-7-11(9)13/h9-10,12H,2-8H2,1H3
InChIKey YPALGXOOHTYQNN-UHFFFAOYSA-N
Molecular Weight 184.279 g/mol
SMILES OCCCCC1C(C(CCC1)=O)C
SPLASH splash10-08fr-9300000000-801d3d4209a9a3aee05e
Wiley ID 1489731