Dataset

Alverine; LC-ESI-QFT; MS2; CE: 30%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01163302 contains the MS2 mass spectrum of Alverine with the InChIkey ZPFXAOWNKLFJDN-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H27N/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20/h3-8,11-14H,2,9-10,15-18H2,1H3
SMILES CCN(CCCC1=CC=CC=C1)CCCC2=CC=CC=C2
InChI Key ZPFXAOWNKLFJDN-UHFFFAOYSA-N
Molecular Formula C20H27N
Exact Mass 281.214 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-EQ01163302
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MetadataPublished 2024-01-16
Related Molecule
  • N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB01616 drugbank
    CHEBI:518413 chebi
    CHEMBL253371 chembl
    83067 surechembl
    3678 pubchem
    46TIR1560O fdasrs
    14185 gtopdb
    PD009447 probes_and_drugs
    HMDB0015554 hmdb
    Molport-001-836-898 molport
    142 drugcentral
    37636 bindingdb
    The data in this table is sourced from UniChem at EBI.