| SpectraBase Spectrum ID |
1QWFVVygPjr |
| Name |
Undecanoate |
| Source of Sample |
SAFC Cat. #W349208 |
| CAS Registry Number |
627-90-7 |
| Classification |
Fatty esters; Fatty acid ethyl 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 |
214.193280075 u |
| Formula |
C13H26O2 |
| InChI |
InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3-12H2,1-2H3 |
| InChIKey |
IAFQYUQIAOWKSB-UHFFFAOYSA-N |
| Molecular Weight |
214.349 g/mol |
| Number of Peaks |
50 |
| RI1 |
1485 |
| RI2 |
1141 |
| RI4 |
1498 |
| RI5 |
1175 |
| SMILES |
C(CCCCCCCCCC)(=O)OCC |
| SPLASH |
splash10-000l-9200000000-86c9d53e92bc9fac7faf |
| 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 |
Undecanoic acid, ethyl ester |
| Wiley ID |
LM_LIPIDS2016_365 |
