Dataset

Ropinirole; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU271103 contains the MS2 mass spectrum of Ropinirole with the InChIkey UHSKFQJFRQCDBE-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H24N2O/c1-3-9-18(10-4-2)11-8-13-6-5-7-15-14(13)12-16(19)17-15/h5-7H,3-4,8-12H2,1-2H3,(H,17,19)
SMILES CCCN(CCC)CCC1=C2CC(=O)NC2=CC=C1
InChI Key UHSKFQJFRQCDBE-UHFFFAOYSA-N
Molecular Formula C16H24N2O
Exact Mass 260.189 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-AU271103
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MetadataPublished 2019-05-30
Related Molecule
  • 4-[2-(dipropylamino)ethyl]-1,3-dihydroindol-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00268 drugbank
    CHEBI:8888 chebi
    CHEMBL589 chembl
    27885263 surechembl
    29374522 surechembl
    35212 surechembl
    5095 pubchem
    030PYR8953 fdasrs
    7295 gtopdb
    PD010133 probes_and_drugs
    HMDB0014413 hmdb
    Molport-003-666-598 molport
    2402 drugcentral
    50020680 bindingdb
    The data in this table is sourced from UniChem at EBI.