Dataset

4'-Hydroxy-5,7-dimethoxyflavanone

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80417 contains the MS mass spectrum of 4'-Hydroxy-5,7-dimethoxyflavanone with the InChIkey REBBZOCNEVVAPX-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H16O5/c1-20-12-7-15(21-2)17-13(19)9-14(22-16(17)8-12)10-3-5-11(18)6-4-10/h3-8,14,18H,9H2,1-2H3
SMILES COC1=CC(=C2C(=O)CC(OC2=C1)C3=CC=C(C=C3)O)OC
InChI Key REBBZOCNEVVAPX-UHFFFAOYSA-N
Molecular Formula C17H16O5
Exact Mass 300.100 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-BML80417
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:26:55.643782
MetadataModified 2024-01-11T22:26:55.800302
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
5271551 PubChem
LMPK12140595 LipidMaps
DTXSID40414920 EPA CompTox Dashboard
MCULE-8068976578 Mcule
4368305 eMolecules
60057383 NMRShiftDB
92389408 PubChem: Thomson Pharma
SCHEMBL5085603 SureChEMBL
CHEMBL2299039 ChEMBL
50488657 BindingDB
J2.848.569G Nikkaji
The data in this table is sourced from UniChem at EBI.