Dataset

Peganine; LC-ESI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81910 contains the MS mass spectrum of Peganine with the InChIkey YIICVSCAKJMMDJ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H12N2O/c14-10-5-6-13-7-8-3-1-2-4-9(8)12-11(10)13/h1-4,10,14H,5-7H2
SMILES C1CN2CC3=CC=CC=C3N=C2C1O
InChI Key YIICVSCAKJMMDJ-UHFFFAOYSA-N
Molecular Formula C11H12N2O
Exact Mass 188.095 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-BML81910
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:181180 chebi
    CHEMBL1186527 chembl
    1923629 surechembl
    31122825 surechembl
    72610 pubchem
    0VFV53RMC2 fdasrs
    PD076967 probes_and_drugs
    TATBEX CCDC
    247299 brenda
    HMDB0256199 hmdb
    Molport-002-933-121 molport
    50594705 bindingdb
    The data in this table is sourced from UniChem at EBI.