Dataset

Dichlofenthion; LC-ESI-QFT; MS2; CE: 60%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01134404 contains the MS2 mass spectrum of Dichlofenthion with the InChIkey WGOWCPGHOCIHBW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H13Cl2O3PS/c1-3-13-16(17,14-4-2)15-10-6-5-8(11)7-9(10)12/h5-7H,3-4H2,1-2H3
SMILES CCOP(=S)(OCC)OC1=C(C=C(C=C1)Cl)Cl
InChI Key WGOWCPGHOCIHBW-UHFFFAOYSA-N
Molecular Formula C10H13Cl2O3PS
Exact Mass 313.970 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01134404
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MetadataPublished 2023-04-27
Related Molecule
  • (2,4-dichlorophenoxy)-diethoxy-sulfanylidene-lambda5-phosphane
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:81730 chebi
    CHEMBL1396626 chembl
    117873 surechembl
    29370476 surechembl
    7328 pubchem
    64234GT8TT fdasrs
    PD202150 probes_and_drugs
    DTXSID8040274 comptox
    Molport-006-109-755 molport
    The data in this table is sourced from UniChem at EBI.