Dataset

Benzyldimethyltetradecylammonium; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU285103 contains the MS2 mass spectrum of Benzyldimethyltetradecylammonium with the InChIkey WNBGYVXHFTYOBY-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C23H42N/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(2,3)22-23-19-16-15-17-20-23/h15-17,19-20H,4-14,18,21-22H2,1-3H3/q+1
SMILES CCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
InChI Key WNBGYVXHFTYOBY-UHFFFAOYSA-N
Molecular Formula [C23H42N]+
Exact Mass 332.332 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-AU285103
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Maintainer
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MetadataPublished 2019-05-31
Related Molecule
  • benzyl-dimethyl-tetradecylazanium
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB13774 drugbank
    CHEMBL1180074 chembl
    176504 surechembl
    8756 pubchem
    I5M8YK41GK fdasrs
    PD013884 probes_and_drugs
    ECUZAE CCDC
    Molport-019-904-813 molport
    50147575 bindingdb
    The data in this table is sourced from UniChem at EBI.