Dataset

5,7-Dihydroxy-3',4'-dimethoxyflavanone; LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-

This MassBank record with Accession MSBNK-BS-BS003537 contains the MS2 mass spectrum of 5,7-Dihydroxy-3',4'-dimethoxyflavanone with the InChIkey HRFSSDXPHTZMLA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H16O6/c1-21-13-4-3-9(5-15(13)22-2)14-8-12(20)17-11(19)6-10(18)7-16(17)23-14/h3-7,14,18-19H,8H2,1-2H3
SMILES C1(=CC(=C2C(=C1)OC(CC2=O)C3=CC=C(OC)C(OC)=C3)O)O
InChI Key HRFSSDXPHTZMLA-UHFFFAOYSA-N
Molecular Formula C17H16O6
Exact Mass 316.095 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-BS003537
Version
Author
Maintainer
Language
MetadataPublished 2017-12-01
Related Molecule
  • 2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J1.920.222D Nikkaji
    172789 Brenda
    CHEMBL2205298 ChEMBL
    14466293 PubChem
    The data in this table is sourced from UniChem at EBI.