Dataset

Dioxabenzofos; LC-ESI-QFT; MS2; CE: 30%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01135502 contains the MS2 mass spectrum of Dioxabenzofos with the InChIkey OUNSASXJZHBGAI-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H9O3PS/c1-9-12(13)10-6-7-4-2-3-5-8(7)11-12/h2-5H,6H2,1H3
SMILES COP1(=S)OCC2=CC=CC=C2O1
InChI Key OUNSASXJZHBGAI-UHFFFAOYSA-N
Molecular Formula C8H9O3PS
Exact Mass 216.001 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-Eawag-EQ01135502
Version
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Maintainer
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MetadataPublished 2023-04-27
Related Molecule
  • 2-methoxy-2-sulfanylidene-4H-1,3,2lambda5-benzodioxaphosphinine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:82120 chebi
    CHEMBL226967 chembl
    83406 surechembl
    19657 pubchem
    6ZWK96BZW6 fdasrs
    Molport-006-109-677 molport
    The data in this table is sourced from UniChem at EBI.