Dataset

Flecainide; LC-ESI-Q; MS; POS; 15 V, 30 V

This MassBank record with Accession MSBNK-Waters-WA000821 contains the MS mass spectrum of Flecainide with the InChIkey DJBNUMBKLMJRSA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)
SMILES C(C2)CNC(C2)CNC(=O)c(c1)c(OCC(F)(F)F)ccc(OCC(F)(F)F)1
InChI Key DJBNUMBKLMJRSA-UHFFFAOYSA-N
Molecular Formula C17H20F6N2O3
Exact Mass 414.138 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-WA000821
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • N-(piperidin-2-ylmethyl)-2,5-bis(2,2,2-trifluoroethoxy)benzamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    3356 PubChem
    PD009747 ProbesDrugs
    LSM-1297 LINCS
    14879920 PubChem: Thomson Pharma
    SCHEMBL14970 SureChEMBL
    PA449646 PharmGKB
    54143-55-4 ACToR
    901891 eMolecules
    75984 ChEBI
    MCULE-3327347453 Mcule
    flecainide DailyMed
    HMDB0015326 Human Metabolome Database
    DB01195 DrugBank
    CHEMBL652 ChEMBL
    C07001 KEGG Ligand
    2560 Guide to Pharmacology
    CB0663265 ChemicalBook
    50131434 BindingDB
    J12.413C Nikkaji
    TAMBOCOR rxnorm
    FLECAINIDE rxnorm
    FLECAINIDE ACETATE rxnorm
    FLECAINIDE clinicaltrials
    FLECAINIDE ACETATE clinicaltrials
    TAMBOCOR clinicaltrials
    K94FTS1806 FDA SRS
    DTXSID8023054 EPA CompTox Dashboard
    1176 DrugCentral
    J399.065F Nikkaji
    J399.064H Nikkaji
    FLECAINIDE DailyMed
    The data in this table is sourced from UniChem at EBI.