Dataset

bisFBSI; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ01118251 contains the MS2 mass spectrum of bisFBSI with the InChIkey KZJUHXVCAHXJLR-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8HF18NO4S2/c9-1(10,5(17,18)19)3(13,14)7(23,24)32(28,29)27-33(30,31)8(25,26)4(15,16)2(11,12)6(20,21)22/h27H
SMILES C(C(C(F)(F)S(=O)(=O)NS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(F)F
InChI Key KZJUHXVCAHXJLR-UHFFFAOYSA-N
Molecular Formula C8HF18NO4S2
Exact Mass 580.906 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-EQ01118251
Version
Author
Maintainer
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MetadataPublished 2024-05-15
Related Molecule
  • 1,1,2,2,3,3,4,4,4-nonafluoro-N-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)butane-1-sulfonamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    899196 surechembl
    10211210 pubchem
    The data in this table is sourced from UniChem at EBI.