| SpectraBase Spectrum ID |
6CkaGG0INp2 |
| Name |
Acetate <3-octyl-> |
| Source of Sample |
SAFC Cat.no. W284823 |
| CAS Registry Number |
4864-61-3 |
| 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 |
172.146329882 u |
| Formula |
C10H20O2 |
| InChI |
InChI=1S/C10H20O2/c1-4-6-7-8-10(5-2)12-9(3)11/h10H,4-8H2,1-3H3 |
| InChIKey |
STZUZYMKSMSTOU-UHFFFAOYSA-N |
| Molecular Weight |
172.268 g/mol |
| Number of Peaks |
22 |
| RI1 |
1120 |
| RI2 |
797 |
| RI3 |
744 |
| RI4 |
698 |
| SMILES |
C(C(CCCCC)OC(=O)C)C |
| SPLASH |
splash10-0006-9100000000-92fea92194963f21bdf1 |
| 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 |
3-Octanol, acetate |
| Wiley ID |
LM_FFNSC3_1784 |
