Dataset

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

This MassBank record with Accession MSBNK-Waters-WA002083 contains the MS mass spectrum of Maprotiline with the InChIkey QSLMDECMDJKHMQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H23N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-5,7-10,15,21H,6,11-14H2,1H3
SMILES CNCCCC(C3)(c21)c(c4)c(ccc4)C(C3)c(cccc2)1
InChI Key QSLMDECMDJKHMQ-UHFFFAOYSA-N
Molecular Formula C20H23N
Exact Mass 277.183 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-WA002083
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • N-methyl-3-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propan-1-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00934 drugbank
    CHEBI:6690 chebi
    CHEMBL21731 chembl
    21994200 surechembl
    29354154 surechembl
    33993 surechembl
    4011 pubchem
    2U1W68TROF fdasrs
    2402 gtopdb
    PD009633 probes_and_drugs
    34575 brenda
    HMDB0015069 hmdb
    Molport-002-507-847 molport
    1634 drugcentral
    35228 bindingdb
    50101973 bindingdb
    The data in this table is sourced from UniChem at EBI.