Dataset

Chlorthiophos; LC-ESI-QFT; MS2; CE: 120%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01133807 contains the MS2 mass spectrum of Chlorthiophos with the InChIkey JAZJVWLGNLCNDD-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H15Cl2O3PS2/c1-4-14-17(18,15-5-2)16-10-6-9(13)11(19-3)7-8(10)12/h6-7H,4-5H2,1-3H3
SMILES CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)SC)Cl
InChI Key JAZJVWLGNLCNDD-UHFFFAOYSA-N
Molecular Formula C11H15Cl2O3PS2
Exact Mass 359.958 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-EQ01133807
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MetadataPublished 2023-04-27
Related Molecule
  • (2,5-dichloro-4-methylsulfanylphenoxy)-diethoxy-sulfanylidene-lambda5-phosphane
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:82109 chebi
    CHEMBL2074800 chembl
    29908516 surechembl
    5933649 surechembl
    30859 pubchem
    1Y631ZW1IN fdasrs
    Molport-003-930-898 molport
    The data in this table is sourced from UniChem at EBI.