| SpectraBase Spectrum ID |
LWpzFabpDcI |
| Name |
Caproate |
| CAS Registry Number |
71271-24-4 |
| 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 |
202.156894565 u |
| Formula |
C11H22O3 |
| InChI |
InChI=1S/C11H22O3/c1-3-4-5-6-7-8-9-10(12)11(13)14-2/h10,12H,3-9H2,1-2H3 |
| InChIKey |
HHHKXSXAGVRUSM-UHFFFAOYSA-N |
| Molecular Weight |
202.294 g/mol |
| Number of Peaks |
119 |
| RI2 |
1381 |
| RI4 |
1430 |
| RI5 |
1110 |
| SMILES |
OC(C(=O)OC)CCCCCCCC |
| SPLASH |
splash10-066u-9200000000-9abac3705e93a4e4c14b |
| 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 |
Decanoic acid, 2-hydroxy-, methyl ester
Me. 2-OH C10:0 |
| Wiley ID |
LM_LIPIDS2016_108 |
