| SpectraBase Spectrum ID |
I4ZNwJAMeBg |
| Name |
Octyl hexanoate |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
368.365430784 u |
| Formula |
C24H48O2 |
| InChI |
InChI=1S/C24H48O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24(25)26-23-21-19-10-8-6-4-2/h3-23H2,1-2H3 |
| InChIKey |
OQILCOQZDHPEAZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
368.646 g/mol |
| Nominal Mass |
368 u |
| Quality |
990 |
| Retention Index |
2592 |
| SMILES |
C(CCCCCCCCCCCCCCC)(OCCCCCCCC)=O |
| SPLASH |
splash10-0bt9-9220000000-0a0a5b670b85e2b66fd0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Hexadecanoic acid,n.-octyl ester
octyl hexadecanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024954 |
