Dataset

Azelastine; LC-ESI-QFT; MS2; CE: 60%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01083207 contains the MS2 mass spectrum of Azelastine with the InChIkey MBUVEWMHONZEQD-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H24ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3
SMILES CN1CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl
InChI Key MBUVEWMHONZEQD-UHFFFAOYSA-N
Molecular Formula C22H24ClN3O
Exact Mass 381.161 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-Eawag-EQ01083207
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MetadataPublished 2024-06-14
Related Molecule
  • 4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)phthalazin-1-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00972 drugbank
    CHEBI:2950 chebi
    CHEMBL639 chembl
    29370712 surechembl
    4239 surechembl
    2267 pubchem
    7121 gtopdb
    PD009611 probes_and_drugs
    ZQI909440X fdasrs
    HMDB0015107 hmdb
    Molport-006-167-674 molport
    271 drugcentral
    50341448 bindingdb
    The data in this table is sourced from UniChem at EBI.