Dataset

Dehydroepiandrosterone; LC-ESI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81060 contains the MS mass spectrum of Dehydroepiandrosterone with the InChIkey FMGSKLZLMKYGDP-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3
SMILES CC12CCC3C(C1CCC2=O)CC=C4C3(CCC(C4)O)C
InChI Key FMGSKLZLMKYGDP-UHFFFAOYSA-N
Molecular Formula C19H28O2
Exact Mass 288.209 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-Washington_State_Univ-BML81060
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:95212 chebi
    CHEMBL31399 chembl
    9969169 surechembl
    76 pubchem
    2370 gtopdb
    PD055511 probes_and_drugs
    ZZZEQE CCDC
    DTXSID801331866 comptox
    The data in this table is sourced from UniChem at EBI.