| SpectraBase Spectrum ID |
BvfTiznQWLM |
| Name |
9,12,15-Octadecatrienoic acid, 2,3-bis(acetyloxy)propyl ester, (Z,Z,Z)- |
| Alternate Name(s) |
(9E,12E,15E)-octadeca-9,12,15-trienoic acid 2,3-diacetoxypropyl ester
2,3-Bis(acetyloxy)propyl (9E,12E,15E)-9,12,15-octadecatrienoate
(9E,12E,15E)-octadeca-9,12,15-trienoic acid 2,3-diacetyloxypropyl ester
2,3-diacetoxypropyl (9E,12E,15E)-octadeca-9,12,15-trienoate
2,3-diacetyloxypropyl (9E,12E,15E)-octadeca-9,12,15-trienoate |
| CAS Registry Number |
55320-02-0 |
| Comments |
Removed after expert review (bad spectrum, m/z 43 too small, 159 too large) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H40O6 |
| InChI |
InChI=1S/C25H40O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)30-21-24(31-23(3)27)20-29-22(2)26/h5-6,8-9,11-12,24H,4,7,10,13-21H2,1-3H3/b6-5+,9-8+,12-11+ |
| InChIKey |
JQOMERQMQGDKLK-XSHSMGBESA-N |
| Molecular Weight |
436.589 g/mol |
| SMILES |
CC(=O)OCC(OC(=O)C)COC(=O)CCCCCCC\C=C\C\C=C\C\C=C\CC |
| SPLASH |
splash10-0a4i-3922000000-627e18cdf11962c3e5a5 |
| Source of Spectrum |
AA-0-2208-1 |
| Wiley ID |
1383559 |
