Dataset

Lauric acid

This MassBank record with Accession MSBNK-Osaka_Univ-OUF00300 contains the MS mass spectrum of Lauric acid with the InChIkey POULHZVOKOAJMA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H,13,14)
SMILES CCCCCCCCCCCC(O)=O
InChI Key POULHZVOKOAJMA-UHFFFAOYSA-N
Molecular Formula C12H24O2
Exact Mass 200.178 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Osaka_Univ-OUF00300
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MetadataPublished 2016-01-19
Related Molecule
  • dodecanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB03017 drugbank
    CHEBI:30805 chebi
    LMFA01010012 lipidmaps
    DAO rcsb_pdb
    LAU rcsb_pdb
    CHEMBL108766 chembl
    5895 surechembl
    3893 pubchem
    1160N9NU9U fdasrs
    5534 gtopdb
    PD020396 probes_and_drugs
    LAURAC CCDC
    137270 brenda
    2019 brenda
    2737 brenda
    912 brenda
    959 brenda
    HMDB0000638 hmdb
    Molport-000-881-524 molport
    4642 drugcentral
    50180948 bindingdb
    The data in this table is sourced from UniChem at EBI.