Dataset

Pyroxsulam; LC-ESI-QTOF; MS2; 40 V

This MassBank record with Accession MSBNK-BAFG-CSL23111019160 contains the MS2 mass spectrum of Pyroxsulam with the InChIkey GLBLPMUBLHYFCW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H13F3N6O5S/c1-26-8-6-9(27-2)23-13(19-8)20-12(21-23)22-29(24,25)10-7(14(15,16)17)4-5-18-11(10)28-3/h4-6H,1-3H3,(H,21,22)
SMILES COC1=CC(=NC2=NC(=NN12)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F)OC
InChI Key GLBLPMUBLHYFCW-UHFFFAOYSA-N
Molecular Formula C14H13F3N6O5S
Exact Mass 434.062 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111019160
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MetadataPublished 2023-11-10
Related Molecule
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  • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    56468840 PubChem: Thomson Pharma
    N9N7LU19AP FDA SRS
    SCHEMBL95924 SureChEMBL
    422556-08-9 ACToR
    11571555 PubChem
    209760 Brenda
    J2.920.568J Nikkaji
    CB71413185 ChemicalBook
    DTXSID7044344 EPA CompTox Dashboard
    The data in this table is sourced from UniChem at EBI.