Dataset

3'-Hydroxyflavone; LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-

This MassBank record with Accession MSBNK-BS-BS003772 contains the MS2 mass spectrum of 3'-Hydroxyflavone with the InChIkey ISZWRZGKEWQACU-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H10O3/c16-11-5-3-4-10(8-11)15-9-13(17)12-6-1-2-7-14(12)18-15/h1-9,16H
SMILES C1(=C(C(=C2C(=C1[H])C(=O)C(=C(O2)C3=C(C(=C(C(=C3[H])[H])[H])O[H])[H])[H])[H])[H])[H]
InChI Key ISZWRZGKEWQACU-UHFFFAOYSA-N
Molecular Formula C15H10O3
Exact Mass 238.063 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003772
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Maintainer
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MetadataPublished 2017-12-01
Related Molecule
  • 2-(3-hydroxyphenyl)chromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    165658 Brenda
    MCULE-6532145595 Mcule
    20234101 NMRShiftDB
    20B PDBe
    PD001194 ProbesDrugs
    70460-18-3 ACToR
    SCHEMBL311580 SureChEMBL
    4368504 eMolecules
    CHEMBL147552 ChEMBL
    229015 PubChem
    J705.725C Nikkaji
    50431165 BindingDB
    ZINC000000057678 ZINC
    DTXSID70281647 EPA CompTox Dashboard
    The data in this table is sourced from UniChem at EBI.