Dataset

6-Methylflavonol; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00294 contains the MS2 mass spectrum of 6-Methylflavonol with the InChIkey KLGALCMPMFKGDQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H12O3/c1-10-7-8-13-12(9-10)14(17)15(18)16(19-13)11-5-3-2-4-6-11/h2-9,18H,1H3
SMILES CC1=CC2=C(C=C1)OC(=C(C2=O)O)C3=CC=CC=C3
InChI Key KLGALCMPMFKGDQ-UHFFFAOYSA-N
Molecular Formula C16H12O3
Exact Mass 252.079 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00294
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 3-hydroxy-6-methyl-2-phenylchromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL483835 chembl
    4650064 surechembl
    227445 pubchem
    Molport-003-178-482 molport
    The data in this table is sourced from UniChem at EBI.