Dataset

Vasicine; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR301219 contains the MS2 mass spectrum of Vasicine with the InChIkey YIICVSCAKJMMDJ-SNVBAGLBSA-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/t10-/m1/s1
SMILES O[C@@H]1CCN2CC3=CC=CC=C3N=C12
InChI Key YIICVSCAKJMMDJ-SNVBAGLBSA-N
Molecular Formula C11H12N2O
Exact Mass 188.230 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301219
Version
Author
Maintainer
Language
MetadataPublished 2019-03-28
Related Molecule
  • (3R)-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:7949 chebi
    CHEMBL1456364 chembl
    31060996 surechembl
    442929 pubchem
    PD176100 probes_and_drugs
    APICIM CCDC
    Molport-002-506-916 molport
    The data in this table is sourced from UniChem at EBI.