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 |