Dataset

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

This MassBank record with Accession MSBNK-Eawag-EQ01133302 contains the MS2 mass spectrum of Carbophenothion with the InChIkey VEDTXTNSFWUXGQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H16ClO2PS3/c1-3-13-15(16,14-4-2)18-9-17-11-7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3
SMILES CCOP(=S)(OCC)SCSC1=CC=C(C=C1)Cl
InChI Key VEDTXTNSFWUXGQ-UHFFFAOYSA-N
Molecular Formula C11H16ClO2PS3
Exact Mass 341.974 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-EQ01133302
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MetadataPublished 2023-04-27
Related Molecule
  • (4-chlorophenyl)sulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:82107 chebi
    CHEMBL452866 chembl
    10754 surechembl
    13081 pubchem
    998NGA2Q61 fdasrs
    DB20408 drugbank
    PD014058 probes_and_drugs
    Molport-003-933-565 molport
    The data in this table is sourced from UniChem at EBI.