SpectraBase Spectrum ID |
Bqtn0XSWbba |
Name |
Stearyl behenate |
Source of Sample |
LARODAN Cat. #45-2218-9;www.larodan.com |
CAS Registry Number |
24271-12-3 |
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 |
592.615831814 u |
Formula |
C40H80O2 |
InChI |
InChI=1S/C40H80O2/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-40(41)42-39-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h3-39H2,1-2H3 |
InChIKey |
GAQPWOABOQGPKA-UHFFFAOYSA-N |
Molecular Weight |
593.078 g/mol |
Number of Peaks |
407 |
RI1 |
4147 |
RI4 |
4166 |
RI5 |
3514 |
SMILES |
C(CCCCCCCCCCCCCCCCCCCCC)(=O)OCCCCCCCCCCCCCCCCCC |
SPLASH |
splash10-0a4l-9200000000-c1b99a7f2b54cee9341c |
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 |
Docosanoic acid, octadecyl ester |
Wiley ID |
LM_LIPIDS2016_247 |