Dataset

Lignoceric acid; LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N109626_9C9C contains the MS2 mass spectrum of Lignoceric acid with the InChIkey QZZGJDVWLFXDLK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C24H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-23H2,1H3,(H,25,26)
SMILES CCCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChI Key QZZGJDVWLFXDLK-UHFFFAOYSA-N
Molecular Formula C24H48O2
Exact Mass 368.365 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N109626_9C9C
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MetadataPublished 2022-04-09
Related Molecule
  • tetracosanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:28866 chebi
    LMFA01010024 lipidmaps
    BZV rcsb_pdb
    CHEMBL1173620 chembl
    132795 surechembl
    11197 pubchem
    RK3VCW5Y1L fdasrs
    PD021423 probes_and_drugs
    107335 brenda
    130857 brenda
    136616 brenda
    164216 brenda
    164218 brenda
    57946 brenda
    61228 brenda
    HMDB0002003 hmdb
    Molport-003-939-501 molport
    The data in this table is sourced from UniChem at EBI.