| SpectraBase Spectrum ID |
9VmMLTmqc2c |
| Name |
(3-hexadecanoyloxy-2-octadeca-9,12-dienoyloxy-propyl) octadec-9-enoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
856.751990934 u |
| Formula |
C55H100O6 |
| InChI |
InChI=1S/C55H100O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h17,20,25-28,52H,4-16,18-19,21-24,29-51H2,1-3H3 |
| InChIKey |
ZDZVWVCNWRMGLA-UHFFFAOYSA-N |
| Instrument Name |
Micromass GCT |
| Ionization Type |
EI positive ion |
| Molecular Weight |
857.399 g/mol |
| Quality |
197 |
| SMILES |
C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COC(CCCCCCCC=CCCCCCCCC)=O)(CCCCCCCCCCCCCCC)=O |
| SPLASH |
splash10-004i-9232073000-0ada623971b2367f71b5 |
| Source of Spectrum |
CN105294438A |
| Wiley ID |
1892635 |
