Dataset

Fraxetin; LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00198 contains the MS2 mass spectrum of Fraxetin with the InChIkey HAVWRBANWNTOJX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3
SMILES COC1=C(C(=C2C(=C1)C=CC(=O)O2)O)O
InChI Key HAVWRBANWNTOJX-UHFFFAOYSA-N
Molecular Formula C10H8O5
Exact Mass 208.037 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-BML00198
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Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 7,8-dihydroxy-6-methoxychromen-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:5169 chebi
    CHEMBL54909 chembl
    30010613 surechembl
    43472 surechembl
    5273569 pubchem
    PD056320 probes_and_drugs
    45527 brenda
    CD3GD44O3K fdasrs
    DTXSID00205992 comptox
    Molport-001-683-945 molport
    50206215 bindingdb
    The data in this table is sourced from UniChem at EBI.