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3-Methylcyclohexanol
SpectraBase Compound ID IEBezEzMYrT
InChI InChI=1S/C7H14O/c1-6-3-2-4-7(8)5-6/h6-8H,2-5H2,1H3
InChIKey HTSABYAWKQAHBT-UHFFFAOYSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hZUyK8nF8v
Name 3-Methylcyclohexanol
Alternate Name(s) Cyclohexanol<3-methyl->
CAS Registry Number 591-23-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C7H14O/c1-6-3-2-4-7(8)5-6/h6-8H,2-5H2,1H3
InChIKey HTSABYAWKQAHBT-UHFFFAOYSA-N
Molecular Weight 114.188 g/mol
SMILES OC1CC(C)CCC1
SPLASH splash10-059y-9000000000-627a3d2e83300e7b1744
Source ex FLUKA ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887270