Dataset

6-2-FTAB; LC-ESI-QFT; MS2; CE: 60%; R=17500; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ01146154 contains the MS2 mass spectrum of 6-2-FTAB with the InChIkey OKOCIUJVPQKDLL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H19F13N2O4S/c1-30(2,8-9(31)32)6-3-5-29-35(33,34)7-4-10(16,17)11(18,19)12(20,21)13(22,23)14(24,25)15(26,27)28/h29H,3-8H2,1-2H3
SMILES C[N+](C)(CCCNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CC(=O)[O-]
InChI Key OKOCIUJVPQKDLL-UHFFFAOYSA-N
Molecular Formula C15H19F13N2O4S
Exact Mass 570.086 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-EQ01146154
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MetadataPublished 2024-05-15
Related Molecule
  • 2-[dimethyl-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonylamino)propyl]azaniumyl]acetate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    34455-29-3 ACToR
    139596175 PubChem
    118691 PubChem
    K7YO4672FB FDA SRS
    DTXSID4041284 EPA CompTox Dashboard
    SCHEMBL18130715 SureChEMBL
    The data in this table is sourced from UniChem at EBI.