Dataset

Carteolol; LC-ESI-Q; MS; POS; 30 V

This MassBank record with Accession MSBNK-Waters-WA001951 contains the MS mass spectrum of Carteolol with the InChIkey LWAFSWPYPHEXKX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)
SMILES OC(CNC(C)(C)C)COc(c2)c(C1)c(cc2)NC(=O)C1
InChI Key LWAFSWPYPHEXKX-UHFFFAOYSA-N
Molecular Formula C16H24N2O3
Exact Mass 292.179 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-WA001951
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-1H-quinolin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00521 drugbank
    CHEBI:3437 chebi
    CHEMBL839 chembl
    23721779 surechembl
    24810 surechembl
    29908301 surechembl
    2583 pubchem
    8NF31401XG fdasrs
    7142 gtopdb
    PD009980 probes_and_drugs
    HMDB0014662 hmdb
    520 drugcentral
    50040065 bindingdb
    The data in this table is sourced from UniChem at EBI.