| SpectraBase Spectrum ID |
6Pjl9mfIHYw |
| Name |
Cyclohexanol <2-tert-butyl-, trans-> acetate |
| CAS Registry Number |
20298-70-8 |
| 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 |
| 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-GHMZBOCLSA-N |
| Molecular Weight |
198.306 g/mol |
| Number of Peaks |
50 |
| RI1 |
1311 |
| RI2 |
988 |
| RI3 |
1005 |
| RI4 |
962 |
| SMILES |
[C@]1([C@@](CCCC1)(C(C)(C)C)[H])(OC(C)=O)[H] |
| SPLASH |
splash10-053r-9000000000-becf62bcb2a2ca7e5d2b |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Cyclohexanol, 2-(1,1-dimethylethyl)-, acetate, (1R,2S)- |
| Wiley ID |
LM_FFNSC3_1611 |
