Dataset

Pirimiphos-methyl; LC-ESI-ITFT; MS2; CE: 55; R=15000; [M]+

This MassBank record with Accession MSBNK-UFZ-UF402817 contains the MS2 mass spectrum of Pirimiphos-methyl with the InChIkey QHOQHJPRIBSPCY-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3
SMILES CCN(CC)C1=NC(C)=CC(OP(=S)(OC)OC)=N1
InChI Key QHOQHJPRIBSPCY-UHFFFAOYSA-N
Molecular Formula C11H20N3O3PS
Exact Mass 305.096 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF402817
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MetadataPublished 2017-01-05
Related Molecule
  • 4-dimethoxyphosphinothioyloxy-N,N-diethyl-6-methylpyrimidin-2-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1886047 ChEMBL
    C18403 KEGG Ligand
    38843 ChEBI
    J3.487H Nikkaji
    HMDB0256600 Human Metabolome Database
    HY-B1881 MedChemExpress
    ZINC000002011556 ZINC
    DTXSID0024266 EPA CompTox Dashboard
    CB7468690 ChemicalBook
    34526 PubChem
    206583 Brenda
    14776340 PubChem: Thomson Pharma
    SCHEMBL26456 SureChEMBL
    29232-93-7 ACToR
    PD158011 ProbesDrugs
    2VQZ4PK548 FDA SRS
    510077 eMolecules
    The data in this table is sourced from UniChem at EBI.