Dataset

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

This MassBank record with Accession MSBNK-Waters-WA000831 contains the MS mass spectrum of Doxapram with the InChIkey XFDJYSQDBULQSI-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C24H30N2O2/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,22H,2,13-19H2,1H3
SMILES C(c(c4)cccc4)(c(c3)cccc3)(C(=O)1)C(CCN(C2)CCOC2)CN(CC)1
InChI Key XFDJYSQDBULQSI-UHFFFAOYSA-N
Molecular Formula C24H30N2O2
Exact Mass 378.231 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-WA000831
Version
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 1-ethyl-4-(2-morpholin-4-ylethyl)-3,3-diphenylpyrrolidin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00561 drugbank
    CHEBI:681848 chebi
    CHEMBL1754 chembl
    644504 surechembl
    3156 pubchem
    94F3830Q73 fdasrs
    7169 gtopdb
    PD009963 probes_and_drugs
    HMDB0014701 hmdb
    Molport-005-933-844 molport
    953 drugcentral
    50505297 bindingdb
    The data in this table is sourced from UniChem at EBI.