Dataset

Dihydrokaempferol

This MassBank record with Accession MSBNK-BS-BS003959 contains the MS2 mass spectrum of Dihydrokaempferol with the InChIkey PADQINQHPQKXNL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H12O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,14-18,20H
SMILES C1(=C(C(=C(C(=C1C2(C(C(=O)C3=C(C(=C(C(=C3O2)[H])O[H])[H])O[H])(O[H])[H])[H])[H])[H])O[H])[H])[H]
InChI Key PADQINQHPQKXNL-UHFFFAOYSA-N
Molecular Formula C15H12O6
Exact Mass 288.063 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-BS003959
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:34:22.691146
MetadataModified 2024-01-11T12:34:22.859282
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
60028989 NMRShiftDB
56407479 PubChem: Thomson Pharma
PD125381 ProbesDrugs
SCHEMBL39319 SureChEMBL
J108.145D Nikkaji
CHEMBL398847 ChEMBL
2555 Brenda
11924 Brenda
DTXSID50274279 EPA CompTox Dashboard
662 PubChem
The data in this table is sourced from UniChem at EBI.