Dataset

7,4'-Dimethoxy-3-hydroxyflavone

This MassBank record with Accession MSBNK-BS-BS003298 contains the MS2 mass spectrum of 7,4'-Dimethoxy-3-hydroxyflavone with the InChIkey IFHXSMSQHPVVSF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)17-16(19)15(18)13-8-7-12(21-2)9-14(13)22-17/h3-9,19H,1-2H3
SMILES C(OC1=C(C(=C(C(=C1[H])[H])C2=C(C(=O)C3=C(O2)C(=C(C(=C3[H])[H])OC([H])([H])[H])[H])O[H])[H])[H])([H])([H])[H]
InChI Key IFHXSMSQHPVVSF-UHFFFAOYSA-N
Molecular Formula C17H14O5
Exact Mass 298.084 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-BS003298
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:33:43.749389
MetadataModified 2024-01-11T12:33:43.898912
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
ZINC000000057890 ZINC
DTXSID00157285 EPA CompTox Dashboard
MCULE-7645150200 Mcule
265699 PubChem
13198-99-7 ACToR
SCHEMBL4650077 SureChEMBL
J46.358B Nikkaji
CHEMBL74913 ChEMBL
735876 eMolecules
The data in this table is sourced from UniChem at EBI.