Dataset

N-MeFOSA; LC-ESI-QFT; MS2; CE: 30%; R=17500; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ00273052 contains the MS2 mass spectrum of N-MeFOSA with the InChIkey SRMWNTGHXHOWBT-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H4F17NO2S/c1-27-30(28,29)9(25,26)7(20,21)5(16,17)3(12,13)2(10,11)4(14,15)6(18,19)8(22,23)24/h27H,1H3
SMILES CNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI Key SRMWNTGHXHOWBT-UHFFFAOYSA-N
Molecular Formula C9H4F17NO2S
Exact Mass 512.969 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-EQ00273052
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MetadataPublished 2024-05-15
Related Molecule
  • 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-methyloctane-1-sulfonamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    3145913 surechembl
    3034468 pubchem
    9XP7JJS624 fdasrs
    PD198420 probes_and_drugs
    The data in this table is sourced from UniChem at EBI.