| SpectraBase Spectrum ID |
BGea2rMF5Vg |
| Name |
Terpinyl acetate |
| CAS Registry Number |
26252-11-9 |
| 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(2)11-5-7-12(4,8-6-11)14-10(3)13/h9,11H,5-8H2,1-4H3 |
| InChIKey |
PXLKJWMSFPYVNB-UHFFFAOYSA-N |
| Molecular Weight |
198.306 g/mol |
| Number of Peaks |
50 |
| RI1 |
1279 |
| RI2 |
957 |
| RI5 |
1265 |
| SMILES |
C(C)(=O)OC1(CCC(CC1)C(C)C)C |
| SPLASH |
splash10-0002-9200000000-f51503de3c14fb83418c |
| 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, 1-methyl-4-(1-methylethyl)-, 1-acetate, trans |
| Wiley ID |
LM_FFNSC3_3216 |
