| SpectraBase Spectrum ID |
G4Tu9es5Bbx |
| Name |
Squalene |
| CAS Registry Number |
111-02-4 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
410.391251610 u |
| Formula |
C30H50 |
| InChI |
InChI=1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h15-18,23-24H,9-14,19-22H2,1-8H3/b27-17+,28-18+,29-23+,30-24+ |
| InChIKey |
YYGNTYWPHWGJRM-AAJYLUCBSA-N |
| Molecular Weight |
410.730 g/mol |
| Number of Peaks |
50 |
| RI1 |
2810 |
| SMILES |
CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C=C/(C)CC\C=C/(C)CCC=C(C)C |
| SPLASH |
splash10-0159-9300000000-8bfa1f82bcb107be9c3b |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
2,6,10,14,18,22-Tetracosahexaene, 2,6,10,15,19,23-hexamethyl-, (all-E)- |
| Wiley ID |
LM_FFNSC3_3335 |
