| SpectraBase Spectrum ID |
5RoPZtWy8gK |
| Name |
Glyceryl tridecanoate |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
621-71-6 |
| Comments |
Saturated glyceryl tridecanoate - Sigma-Aldrich
Solvent CDCl3, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C33 H62 O6 |
| IUPAC Name |
1,3-di(decanoyloxy)propan-2-yl decanoate; capric acid [2-capryloxy-1-(capryloxymethyl)ethyl] ester; [2-decanoyloxy-1-(decanoyloxymethyl)ethyl] decanoate; decanoic acid [2-(1-oxodecoxy)-1-(1-oxodecoxymethyl)ethyl] ester |
| InChI |
InChI=1S/C33H62O6/c1-4-7-10-13-16-19-22-25-31(34)37-28-30(39-33(36)27-24-21-18-15-12-9-6-3)29-38-32(35)26-23-20-17-14-11-8-5-2/h30H,4-29H2,1-3H3 |
| InChIKey |
LADGBHLMCUINGV-UHFFFAOYSA-N |
| PubChem Compound ID |
69310 |
| SMILES |
CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC |
| Source File Reference |
bmse000566 |
