| SpectraBase Spectrum ID |
FLJzOmWbR92 |
| Name |
linolenic acid, 1TMS |
| Alternate Name(s) |
linolenate, 1TMS
alpha-Linolenic acid, 1TMS
alpha-Lnn, 1TMS
alpha-Linolenate, 1TMS
Linolenic acid (8CI), 1TMS
(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid, 1TMS
Trimethylsilyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate |
| Comments |
Derivatization type: 1 TMS (mass: 350.264); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000701; Note: The molecular formula of the structure shown is C18H30O2 - which differs from the formula reported for the mass spectrum (C21H38O2Si) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H38O2Si |
| InChI |
InChI=1S/C21H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h6-7,9-10,12-13H,5,8,11,14-20H2,1-4H3/b7-6-,10-9-,13-12- |
| InChIKey |
DCFAEXKJEMZTKR-QNEBEIHSSA-N |
| Molecular Weight |
350.618 g/mol |
| SMILES |
CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)O[Si](C)(C)C |
| SPLASH |
splash10-052f-5900000000-7a729281e08790e0ea25 |
| Source of Spectrum |
FM-2019-701-0 |
| Wiley ID |
1818379 |
