Dataset

Flumetsulam; LC-ESI-QQ; MS2; CE:50 V; [M+H]+

This MassBank record with Accession MSBNK-Waters-WA000243 contains the MS2 mass spectrum of Flumetsulam with the InChIkey RXCPQSJAVKGONC-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H9F2N5O2S/c1-7-5-6-19-11(15-7)16-12(17-19)22(20,21)18-10-8(13)3-2-4-9(10)14/h2-6,18H,1H3
SMILES CC(C=3)=Nc(n1)n(C3)nc1S(=O)(=O)Nc(c(F)2)c(F)ccc2
InChI Key RXCPQSJAVKGONC-UHFFFAOYSA-N
Molecular Formula C12H9F2N5O2S
Exact Mass 325.045 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000243
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MetadataPublished 2016-01-19
Related Molecule
  • N-(2,6-difluorophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:82011 chebi
    CHEMBL1389671 chembl
    54906 surechembl
    91759 pubchem
    X89F0S6LW8 fdasrs
    PD211424 probes_and_drugs
    MAPPUP CCDC
    87727 brenda
    Molport-002-818-112 molport
    50004708 bindingdb
    The data in this table is sourced from UniChem at EBI.