Dataset

Droperidol; LC-ESI-QTOF; MS2; HILIC; CE: 50 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU120711 contains the MS2 mass spectrum of Droperidol with the InChIkey RMEDXOLNCUSCGS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H22FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-11H,3,6,12-15H2,(H,24,28)
SMILES c1ccc2c(c1)nc(n2C3=CCN(CC3)CCCC(=O)c4ccc(cc4)F)O
InChI Key RMEDXOLNCUSCGS-UHFFFAOYSA-N
Molecular Formula C22H22FN3O2
Exact Mass 379.170 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-AU120711
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MetadataPublished 2016-02-25
Related Molecule
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  • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00450 drugbank
    CHEBI:4717 chebi
    USS rcsb_pdb
    CHEMBL1108 chembl
    29364550 surechembl
    41426 surechembl
    3168 pubchem
    O9U0F09D5X fdasrs
    7172 gtopdb
    PD001512 probes_and_drugs
    GIXXOB CCDC
    217393 brenda
    HMDB0014593 hmdb
    Molport-003-666-341 molport
    966 drugcentral
    50017705 bindingdb
    The data in this table is sourced from UniChem at EBI.