Dataset

Pipamperone; LC-ESI-QTOF; MS2; CE: Ramp 23.1-34.7 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU251406 contains the MS2 mass spectrum of Pipamperone with the InChIkey AXKPFOAXAHJUAG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H30FN3O2/c22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25/h6-9H,1-5,10-16H2,(H2,23,27)
SMILES NC(=O)C1(CCN(CCCC(=O)C2=CC=C(F)C=C2)CC1)N1CCCCC1
InChI Key AXKPFOAXAHJUAG-UHFFFAOYSA-N
Molecular Formula C21H30FN3O2
Exact Mass 375.232 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU251406
Version
Author
Maintainer
Language
MetadataPublished 2019-04-08
Related Molecule
  • 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidin-1-ylpiperidine-4-carboxamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB09286 drugbank
    CHEBI:78549 chebi
    CHEMBL440294 chembl
    2412 surechembl
    4830 pubchem
    5402501F0W fdasrs
    92 gtopdb
    PD000333 probes_and_drugs
    PIPAMP CCDC
    HMDB0256570 hmdb
    Molport-003-666-738 molport
    2181 drugcentral
    81483 bindingdb
    The data in this table is sourced from UniChem at EBI.