Dataset

2-HYDROXY-5,7-DIMETHOXY-1,4-NAPHTHOQUINONE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP000750 contains the MS mass spectrum of 2-HYDROXY-5,7-DIMETHOXY-1,4-NAPHTHOQUINONE with the InChIkey ADTSNWYKAAWAQG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H10O5/c1-16-6-3-7-11(10(4-6)17-2)8(13)5-9(14)12(7)15/h3-5,14H,1-2H3
SMILES COc(c1)cc(c(=O)2)c(c(=O)cc(O)2)c(OC)1
InChI Key ADTSNWYKAAWAQG-UHFFFAOYSA-N
Molecular Formula C12H10O5
Exact Mass 234.053 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-Fac_Eng_Univ_Tokyo-JP000750
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • nfdi4chem-mol46666(Unknown Molecule)
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL4215721 chembl
    The data in this table is sourced from UniChem at EBI.