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trans-2-Tert-butylcyclohexanol acetate
SpectraBase Compound ID LJgR0yimo05
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-RRKGBCIJSA-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 9Ih0JHnkIEq
Name trans-2-Tert-butylcyclohexanol acetate
CAS Registry Number 20298-70-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
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/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-RRKGBCIJSA-N
Molecular Weight 198.306 g/mol
SMILES CC(=O)O[C@@]1(CCCCC1C(C)(C)C)[H]
SPLASH splash10-0536-9000000000-a1b5a4e04a2a05e50126
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Cyclohexanol acetate
Wiley ID 1887272