Dataset

3-Hydroxy-3',4'-Dimethoxyflavone

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01420 contains the MS2 mass spectrum of 3-Hydroxy-3',4'-Dimethoxyflavone with the InChIkey BXLAVJWSFYZDPF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H14O5/c1-20-13-8-7-10(9-14(13)21-2)17-16(19)15(18)11-5-3-4-6-12(11)22-17/h3-9,19H,1-2H3
SMILES COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)O)OC
InChI Key BXLAVJWSFYZDPF-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-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01420
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:20:49.452216
MetadataModified 2025-02-09T20:07:51.171303
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MCULE-1160192481 Mcule
97143 PubChem
6889-80-1 ACToR
56398349 PubChem: Thomson Pharma
CB32604548 ChemicalBook
SCHEMBL4285872 SureChEMBL
9B35R9JIHA FDA SRS
735902 eMolecules
MOPJIM CCDC
DTXSID20218968 EPA CompTox Dashboard
J1.415.485J Nikkaji
ZINC000000039299 ZINC
CHEMBL77098 ChEMBL
The data in this table is sourced from UniChem at EBI.