For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
11-Eicosaenoic acid 1TMS
SpectraBase Compound ID 54YHYiWUGuU
InChI InChI=1S/C23H46O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-26(2,3)4/h12-13H,5-11,14-22H2,1-4H3/b13-12-
InChIKey NDMDMKUTWQZQOU-SEYXRHQNSA-N
Mol Weight 382.7 g/mol
Molecular Formula C23H46O2Si
Exact Mass 382.326707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1Wo5yQ0pFmj
Name cis-gondoic acid, 1TMS
Comments Derivatization type: 1 TMS (mass: 382.327); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001099; Note: The molecular formula of the structure shown is C20H38O2 - which differs from the formula reported for the mass spectrum (C23H46O2Si)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H46O2Si
InChI InChI=1S/C23H46O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-26(2,3)4/h12-13H,5-11,14-22H2,1-4H3/b13-12-
InChIKey NDMDMKUTWQZQOU-SEYXRHQNSA-N
Molecular Weight 382.704 g/mol
SMILES CCCCCCCC\C=C/CCCCCCCCCC(=O)O[Si](C)(C)C
SPLASH splash10-00mk-3900000000-b782a439f50f24586a19
Source of Spectrum FM-2019-1099-0
Synonyms gondoic acid, 1TMS 11-Eicosenoic acid, 1TMS 11Z-eicosenoic acid, 1TMS cis-11-eicosenoic acid, 1TMS cis-11-icosenoic acid, 1TMS (Z)-icos-11-enoic acid, 1TMS Trimethylsilyl (Z)-icos-11-enoate
Wiley ID 1818757