| SpectraBase Spectrum ID |
LZ5jISkFOf0 |
| Name |
Octanoate |
| Source of Sample |
SAFC Cat.no. W203718 |
| CAS Registry Number |
4230-97-1 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
184.146329882 u |
| Formula |
C11H20O2 |
| InChI |
InChI=1S/C11H20O2/c1-3-5-6-7-8-9-11(12)13-10-4-2/h4H,2-3,5-10H2,1H3 |
| InChIKey |
PZGMUSDNQDCNAG-UHFFFAOYSA-N |
| Molecular Weight |
184.279 g/mol |
| Number of Peaks |
50 |
| RI1 |
1281 |
| RI2 |
959 |
| RI3 |
1183 |
| RI4 |
941 |
| SMILES |
C(CCCCCCC)(=O)OCC=C |
| SPLASH |
splash10-0a4l-9200000000-a6e60d9f0759a6dcdb1d |
| 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 |
Octanoic acid, 2-propenyl ester |
| Wiley ID |
LM_FFNSC3_187 |
