SpectraBase Spectrum ID |
7ErxVbOh19m |
Name |
Behenyl arachidate |
Source of Sample |
LARODAN Cat. #45-2022-9;www.larodan.com |
CAS Registry Number |
42232-87-1 |
Classification |
Fatty esters; Wax monoesters |
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 |
620.647131943 u |
Formula |
C42H84O2 |
InChI |
InChI=1S/C42H84O2/c1-3-5-7-9-11-13-15-17-19-21-22-23-25-27-29-31-33-35-37-39-41-44-42(43)40-38-36-34-32-30-28-26-24-20-18-16-14-12-10-8-6-4-2/h3-41H2,1-2H3 |
InChIKey |
XRBFFXWJPXHRME-UHFFFAOYSA-N |
Molecular Weight |
621.132 g/mol |
Number of Peaks |
447 |
RI1 |
4342 |
RI4 |
4358 |
RI5 |
3643 |
SMILES |
C(CCCCCCCCCCCCCCCCCCC)(=O)OCCCCCCCCCCCCCCCCCCCCCC |
SPLASH |
splash10-0bt9-9301000000-852b933f0e7a20ae8eec |
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 |
Eicosanoic acid, docosyl ester |
Wiley ID |
LM_LIPIDS2016_254 |