Dataset

IQ; APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+

This MassBank record with Accession MSBNK-UFZ-UA000503 contains the MS2 mass spectrum of IQ with the InChIkey ARZWATDYIYAUTA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H10N4/c1-15-9-5-4-8-7(3-2-6-13-8)10(9)14-11(15)12/h2-6H,1H3,(H2,12,14)
SMILES Cn1c2c(c3c(cc2)nccc3)nc1N
InChI Key ARZWATDYIYAUTA-UHFFFAOYSA-N
Molecular Formula C11H10N4
Exact Mass 198.090 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-UFZ-UA000503
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MetadataPublished 2014-06-24
Related Molecule
  • 3-methylimidazo[4,5-f]quinolin-2-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:42725 chebi
    GIQ rcsb_pdb
    CHEMBL1233049 chembl
    605923 surechembl
    53462 pubchem
    30GL3D3T0G fdasrs
    PD061036 probes_and_drugs
    AMQUIN CCDC
    163880 brenda
    HMDB0029706 hmdb
    Molport-001-759-122 molport
    The data in this table is sourced from UniChem at EBI.