Dataset

DOCOSANOIC ACID TRIMETHYLSILYL ESTER; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP000576 contains the MS mass spectrum of DOCOSANOIC ACID TRIMETHYLSILYL ESTER with the InChIkey BJBBFOVJCKMBAL-UHFFFAOYSA-N.

Chemical Information

Molecular Image
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
SMILES CCCCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C
InChI Key BJBBFOVJCKMBAL-UHFFFAOYSA-N
Molecular Formula C25H52O2Si
Exact Mass 412.374 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP000576
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • trimethylsilyl docosanoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    6554451 surechembl
    522539 pubchem
    DTXSID50334988 comptox
    The data in this table is sourced from UniChem at EBI.