Dataset

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

This MassBank record with Accession MSBNK-Waters-WA000840 contains the MS mass spectrum of Disopyramide with the InChIkey UVTNFZQICZKOEM-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H29N3O/c1-16(2)24(17(3)4)15-13-21(20(22)25,18-10-6-5-7-11-18)19-12-8-9-14-23-19/h5-12,14,16-17H,13,15H2,1-4H3,(H2,22,25)
SMILES CC(C)N(C(C)C)CCC(C(N)=O)(c(c2)cccc2)c(c1)nccc1
InChI Key UVTNFZQICZKOEM-UHFFFAOYSA-N
Molecular Formula C21H29N3O
Exact Mass 339.231 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-WA000840
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 4-[di(propan-2-yl)amino]-2-phenyl-2-pyridin-2-ylbutanamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00280 drugbank
    CHEBI:4657 chebi
    CHEMBL517 chembl
    16153 surechembl
    23931452 surechembl
    3114 pubchem
    GFO928U8MQ fdasrs
    7167 gtopdb
    PD002749 probes_and_drugs
    HMDB0014425 hmdb
    DTXSID1045536 comptox
    NCT00000556 clinicaltrials
    NCT00589303 clinicaltrials
    Molport-003-846-985 molport
    926 drugcentral
    50028893 bindingdb
    The data in this table is sourced from UniChem at EBI.