Dataset

Chrysazin; LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-

This MassBank record with Accession MSBNK-HBM4EU-HB003398 contains the MS2 mass spectrum of Chrysazin with the InChIkey QBPFLULOKWLNNW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6,15-16H
SMILES C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O
InChI Key QBPFLULOKWLNNW-UHFFFAOYSA-N
Molecular Formula C14H8O4
Exact Mass 240.042 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-HBM4EU-HB003398
Version
Author
Maintainer
Language
MetadataPublished 2021-10-11
Related Molecule
  • 1,8-dihydroxyanthracene-9,10-dione
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB04816 drugbank
    CHEBI:3682 chebi
    CHZ rcsb_pdb
    CHEMBL53418 chembl
    29356886 surechembl
    30544826 surechembl
    83688 surechembl
    2950 pubchem
    CHZ pdbe
    PD002124 probes_and_drugs
    DHANQU CCDC
    220864 brenda
    27107 brenda
    28096 brenda
    42878 brenda
    51583 brenda
    7508 brenda
    Z4XE6IBF3V fdasrs
    HMDB0029752 hmdb
    Molport-000-564-798 molport
    3125 drugcentral
    11316 bindingdb
    The data in this table is sourced from UniChem at EBI.