Dataset

Kaempferol; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-NaToxAq-NA003756 contains the MS2 mass spectrum of Kaempferol with the InChIkey IYRMWMYZSQPJKC-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
SMILES OC1=CC=C(C=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1
InChI Key IYRMWMYZSQPJKC-UHFFFAOYSA-N
Molecular Formula C15H10O6
Exact Mass 286.048 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-NaToxAq-NA003756
Version
Author
Maintainer
Language
MetadataPublished 2020-02-22
Related Molecule
  • 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB01852 drugbank
    CHEBI:28499 chebi
    LMPK12110003 lipidmaps
    KMP rcsb_pdb
    CHEMBL150 chembl
    18817 surechembl
    29378805 surechembl
    5280863 pubchem
    731P2LE49E fdasrs
    11052 gtopdb
    PD000231 probes_and_drugs
    EJEPOA CCDC
    243651 brenda
    35794 brenda
    408 brenda
    43511 brenda
    62438 brenda
    7628 brenda
    HMDB0005801 hmdb
    Molport-001-741-568 molport
    7462 bindingdb
    The data in this table is sourced from UniChem at EBI.