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1,1,2,2,3,3,4,4,4-Nonafluoro-N-(1-phenylethyl)butane-1-sulfonamide
SpectraBase Compound ID 3VbUNhTwhOy
InChI InChI=1S/C12H10F9NO2S/c1-7(8-5-3-2-4-6-8)22-25(23,24)12(20,21)10(15,16)9(13,14)11(17,18)19/h2-7,22H,1H3
InChIKey XWDPHGLJEQFYRP-UHFFFAOYSA-N
Mol Weight 403.26 g/mol
Molecular Formula C12H10F9NO2S
Exact Mass 403.028853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fkKtFp6Tn0
Name 1,1,2,2,3,3,4,4,4-Nonafluoro-N-(1-phenylethyl)butane-1-sulfonamide
Appearance Colorless oil
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Formula C12H10F9NO2S
InChI InChI=1S/C12H10F9NO2S/c1-7(8-5-3-2-4-6-8)22-25(23,24)12(20,21)10(15,16)9(13,14)11(17,18)19/h2-7,22H,1H3
InChIKey XWDPHGLJEQFYRP-UHFFFAOYSA-N
Instrument Name Waters GCT Premier
Ionization Type EI
Literature Reference DOI 10.1002/anie.201905209
Molecular Weight 403.263 g/mol
Reported Formula C12H10F9NO2S
SMILES N(S(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(=O)=O)C(c1ccccc1)C
SPLASH splash10-052r-0509000000-12797d728023b0a5b319
Source of Spectrum ACI-58-SM18-7k
Thin-Layer Chromatography Rf = 0.5 (hexane/AcOEt, 5:1)
Wiley ID 1875448