Dataset

Dodecanoic acid; GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU507904 contains the MS2 mass spectrum of Dodecanoic 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/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU507904
Version
Author
Maintainer
Language
MetadataPublished 2021-04-20
Related Molecule
  • dodecanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.