| SpectraBase Spectrum ID |
4p1jQlqwIts |
| Name |
Pentanoate |
| CAS Registry Number |
35852-46-1 |
| 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 |
184.146329882 u |
| Formula |
C11H20O2 |
| InChI |
InChI=1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h5,7H,3-4,6,8-10H2,1-2H3/b7-5- |
| InChIKey |
XPFTVTFOOTVHIA-ALCCZGGFSA-N |
| Molecular Weight |
184.279 g/mol |
| Number of Peaks |
50 |
| RI1 |
1282 |
| RI2 |
960 |
| SMILES |
C(COC(CCCC)=O)\C=C/CC |
| SPLASH |
splash10-067i-9000000000-fdb520665977274a02f0 |
| 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 |
Pentanoic acid, (3Z)-3-hexenyl ester |
| Wiley ID |
LM_FFNSC3_1369 |
