| SpectraBase Spectrum ID |
JHvHtxsFU36 |
| Name |
Dicaprylin |
| CAS Registry Number |
1069-87-0 |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
344.256274254 u |
| Formula |
C19H36O5 |
| InChI |
InChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3 |
| InChIKey |
ZQBULZYTDGUSSK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
344.492 g/mol |
| Nominal Mass |
344 u |
| Quality |
996 |
| Retention Index |
2405 |
| SMILES |
OCC(OC(CCCCCCC)=O)COC(CCCCCCC)=O |
| SPLASH |
splash10-056u-9610000000-4e0ae7d568f5ad153145 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,2-Dioctanoin
1-Hydroxy-3-(octanoyloxy)propan-2-yl octanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029605 |
