| SpectraBase Spectrum ID |
G57elFYy92q |
| Name |
3-Hydroxynonanoate |
| CAS Registry Number |
83968-06-3 |
| Classification |
Fatty esters; Fatty acid methyl esters |
| 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 |
188.141244501 u |
| Formula |
C10H20O3 |
| InChI |
InChI=1S/C10H20O3/c1-3-4-5-6-7-9(11)8-10(12)13-2/h9,11H,3-8H2,1-2H3 |
| InChIKey |
KHCQOQFCKCGHHU-UHFFFAOYSA-N |
| Molecular Weight |
188.267 g/mol |
| Number of Peaks |
121 |
| RI2 |
1367 |
| RI4 |
1359 |
| RI5 |
1037 |
| SMILES |
OC(CC(=O)OC)CCCCCC |
| SPLASH |
splash10-0ukc-9400000000-aca57c5017f86e9b0d7e |
| Sample Comments |
RI1: measured on Equity-1 (Alkanes)
RI2: measured on Supelcowax-10 (FAMEs)
RI3: measured on Supelcowax-10 (FAEEs)
RI4: measured on SLB-5ms (Alkanes)
RI5: measured on SLB-5ms (FAMEs) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Nonanoic acid, 3-hydroxy-, methyl ester
Me. 3-OH C9:0 |
| Wiley ID |
LM_LIPIDS2016_184 |
