Dataset

5-Carboline; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU288105 contains the MS2 mass spectrum of 5-Carboline with the InChIkey RDMFHRSPDKWERA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-7,13H
SMILES N1C2=C(C=CC=C2)C2=C1C=CN=C2
InChI Key RDMFHRSPDKWERA-UHFFFAOYSA-N
Molecular Formula C11H8N2
Exact Mass 168.069 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-AU288105
Version
Author
Maintainer
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MetadataPublished 2019-05-31
Related Molecule
  • 5H-pyrido[4,3-b]indole
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:182291 chebi
    CHEMBL12540 chembl
    121401 surechembl
    29382084 surechembl
    130802 pubchem
    89407EP2HE fdasrs
    SEMSEJ CCDC
    HMDB0247024 hmdb
    Molport-002-483-608 molport
    50572080 bindingdb
    The data in this table is sourced from UniChem at EBI.