Dataset

N-methylcorydaldine; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00795 contains the MS2 mass spectrum of N-methylcorydaldine with the InChIkey BDIZBBGNYDRCCA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H15NO3/c1-13-5-4-8-6-10(15-2)11(16-3)7-9(8)12(13)14/h6-7H,4-5H2,1-3H3
SMILES CN1CCC2=CC(=C(C=C2C1=O)OC)OC
InChI Key BDIZBBGNYDRCCA-UHFFFAOYSA-N
Molecular Formula C12H15NO3
Exact Mass 221.105 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-BML00795
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:67411 chebi
    CHEMBL504722 chembl
    11923834 surechembl
    30883376 surechembl
    303906 pubchem
    NAMQUO CCDC
    Molport-002-515-514 molport
    50349827 bindingdb
    The data in this table is sourced from UniChem at EBI.