Dataset

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

This MassBank record with Accession MSBNK-Waters-WA002649 contains the MS mass spectrum of Naftidrofuryl with the InChIkey KBAFPSLPKGSANY-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C24H33NO3/c1-3-25(4-2)14-16-28-24(26)21(18-22-12-8-15-27-22)17-20-11-7-10-19-9-5-6-13-23(19)20/h5-7,9-11,13,21-22H,3-4,8,12,14-18H2,1-2H3
SMILES CCN(CC)CCOC(=O)C(CC(C3)OCC3)Cc(c1)c(c2)c(ccc2)cc1
InChI Key KBAFPSLPKGSANY-UHFFFAOYSA-N
Molecular Formula C24H33NO3
Exact Mass 383.246 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-WA002649
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MetadataPublished 2016-01-19
Related Molecule
  • 2-(diethylamino)ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB13588 drugbank
    CHEBI:91817 chebi
    CHEMBL1620794 chembl
    29405813 surechembl
    34062 surechembl
    4417 pubchem
    42H8PQ0NMJ fdasrs
    PD013143 probes_and_drugs
    HMDB0255425 hmdb
    Molport-002-614-063 molport
    1870 drugcentral
    50347133 bindingdb
    The data in this table is sourced from UniChem at EBI.