Dataset

Fipronil-sulfone; LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EA266763 contains the MS2 mass spectrum of Fipronil-sulfone with the InChIkey LGHZJDKSVUTELU-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2
SMILES NC1=C(C(=NN1c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)S(=O)(=O)C(F)(F)F
InChI Key LGHZJDKSVUTELU-UHFFFAOYSA-N
Molecular Formula C12H4Cl2F6N4O2S
Exact Mass 451.934 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EA266763
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MetadataPublished 2014-01-14
Related Molecule
  • 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfonyl)pyrazole-3-carbonitrile
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.