SpectraBase Spectrum ID |
85uDl12iBYR |
Name |
Stearyl stearate |
Source of Sample |
LARODAN Cat. #45-1818-9;www.larodan.com |
CAS Registry Number |
2778-96-3 |
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 |
536.553231556 u |
Formula |
C36H72O2 |
InChI |
InChI=1S/C36H72O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-35H2,1-2H3 |
InChIKey |
NKBWPOSQERPBFI-UHFFFAOYSA-N |
Molecular Weight |
536.970 g/mol |
Number of Peaks |
385 |
RI1 |
3752 |
RI4 |
3770 |
RI5 |
3245 |
SMILES |
C(CCCCCCCCCCCCCCCCC)(=O)OCCCCCCCCCCCCCCCCCC |
SPLASH |
splash10-0a4r-9320000000-699d6b49e75a2bb5a311 |
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 |
Octadecanoic acid, octadecyl ester |
Wiley ID |
LM_LIPIDS2016_276 |