Dataset

Fenfluramine; LC-ESI-Q; MS; POS; 60 V

This MassBank record with Accession MSBNK-Waters-WA001011 contains the MS mass spectrum of Fenfluramine with the InChIkey DBGIVFWFUFKIQN-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H16F3N/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9,16H,3,7H2,1-2H3
SMILES CCNC(C)Cc(c1)cc(cc1)C(F)(F)F
InChI Key DBGIVFWFUFKIQN-UHFFFAOYSA-N
Molecular Formula C12H16F3N
Exact Mass 231.123 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-WA001011
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • N-ethyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    PA164747936 PharmGKB
    3337 PubChem
    PD008865 ProbesDrugs
    FINTEPLA clinicaltrials
    15172399 PubChem: Thomson Pharma
    5220-89-3 ACToR
    458-24-2 ACToR
    PA449592 PharmGKB
    SCHEMBL16215 SureChEMBL
    CHEMBL87493 ChEMBL
    C06996 KEGG Ligand
    5000 ChEBI
    DB00574 DrugBank
    CB0314194 ChemicalBook
    FENFLURAMINE DailyMed
    84738 BindingDB
    FENFLURAMINE HYDROCHLORIDE rxnorm
    S-768 clinicaltrials
    FENFLURAMINE clinicaltrials
    FENFLURAMINE HYDROCHLORIDE clinicaltrials
    ZX-008 clinicaltrials
    ZX008 clinicaltrials
    2DS058H2CF FDA SRS
    DTXSID4023044 EPA CompTox Dashboard
    1150 DrugCentral
    4613 Guide to Pharmacology
    J5.760F Nikkaji
    HMDB0252200 Human Metabolome Database
    FENFLURAMINE rxnorm
    The data in this table is sourced from UniChem at EBI.