| SpectraBase Spectrum ID |
70EA0l5dnuk |
| Name |
behenic acid, 1TMS |
| Alternate Name(s) |
Docosanoic acid, 1TMS
Behenic acid, 1TMS
Docosoic acid, 1TMS
Docosansaeure, 1TMS
Dokosansaeure, 1TMS
Behensaeure, 1TMS
Docosanoic acid, 1TMS
Trimethylsilyl docosanoate |
| Comments |
Derivatization type: 1 TMS (mass: 412.374); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000582; Note: The molecular formula of the structure shown is C22H44O2 - which differs from the formula reported for the mass spectrum (C25H52O2Si) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H52O2Si |
| InChI |
InChI=1S/C25H52O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27-28(2,3)4/h5-24H2,1-4H3 |
| InChIKey |
BJBBFOVJCKMBAL-UHFFFAOYSA-N |
| Molecular Weight |
412.774 g/mol |
| SMILES |
CCCCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C |
| SPLASH |
splash10-0159-1900000000-dc36072a48394dff7152 |
| Source of Spectrum |
FM-2019-582-0 |
| Wiley ID |
1818263 |
