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cis-2-Tert-butylcyclohexanol acetate
SpectraBase Compound ID D29sm9dfczh
InChI InChI=1S/C12H22O2/c1-9(13)14-11-8-6-5-7-10(11)12(2,3)4/h10-11H,5-8H2,1-4H3/t10-,11+/m1/s1
InChIKey FINOAUDUYKVGDS-MNOVXSKESA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrNkWjNi8H
Name Cyclohexanol acetate
CAS Registry Number 20298-69-5
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 198.161979946 u
Formula C12H22O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C12H22O2/c1-9(13)14-11-8-6-5-7-10(11)12(2,3)4/h10-11H,5-8H2,1-4H3/t10-,11+/m1/s1
InChIKey FINOAUDUYKVGDS-MNOVXSKESA-N
Molecular Weight 198.306 g/mol
Nominal Mass 198 u
Number of Peaks 80
SMILES CC(=O)O[C@]1(CCCC[C@]1(C(C)(C)C)[H])[H]
SPLASH splash10-0536-9000000000-086441d241ee9f850a88
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001510