Dataset

Fenpiverinium; LC-ESI-Q; MS; POS; 45 V

This MassBank record with Accession MSBNK-Waters-WA002737 contains the MS mass spectrum of Fenpiverinium with the InChIkey QDIYJDPBMZUZEH-UHFFFAOYSA-O.

Chemical Information

molecular Image
InChI InChI=1S/C22H28N2O/c1-24(16-9-4-10-17-24)18-15-22(21(23)25,19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-3,5-8,11-14H,4,9-10,15-18H2,1H3,(H-,23,25)/p+1
SMILES C(C3)CC[N+1](C)(C3)CCC(C(N)=O)(c(c2)cccc2)c(c1)cccc1
InChI Key QDIYJDPBMZUZEH-UHFFFAOYSA-O
Molecular Formula [C22H29N2O]+
Exact Mass 337.228 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002737
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1884833 ChEMBL
    DB13759 DrugBank
    DTXSID7048376 EPA CompTox Dashboard
    J292.587G Nikkaji
    94773 ChEBI
    ZINC000000001439 ZINC
    1160 DrugCentral
    71490 PubChem
    SCHEMBL1650132 SureChEMBL
    LSM-5905 LINCS
    KP2L8LC73B FDA SRS
    FENPIVERINIUM BROMIDE clinicaltrials
    FENPIVERINIUM clinicaltrials
    PD014258 ProbesDrugs
    258329-46-3 ACToR
    The data in this table is sourced from UniChem at EBI.