Dataset

4-Hydroxyquinoline; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU249201 contains the MS2 mass spectrum of 4-Hydroxyquinoline with the InChIkey PMZDQRJGMBOQBF-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6H,(H,10,11)
SMILES OC1=CC=NC2=CC=CC=C12
InChI Key PMZDQRJGMBOQBF-UHFFFAOYSA-N
Molecular Formula C9H7NO
Exact Mass 145.053 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-AU249201
Version
Author
Maintainer
Language
MetadataPublished 2019-04-05
Related Molecule
  • 1H-quinolin-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:155900 chebi
    CHEBI:15815 chebi
    ES1 rcsb_pdb
    CHEMBL1232567 chembl
    10031 surechembl
    128549 surechembl
    69141 pubchem
    M1O131WXFO fdasrs
    PD098672 probes_and_drugs
    NICJOZ CCDC
    135636 brenda
    169670 brenda
    22073 brenda
    29311 brenda
    97067 brenda
    HMDB0246466 hmdb
    Molport-000-140-057 molport
    Molport-003-986-116 molport
    14321 bindingdb
    The data in this table is sourced from UniChem at EBI.