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1,1,1-Trifluoro-N-(1-(4-(trifluoromethyl)phenyl)vinyl)-N-((trifluoromethyl)-sulfonyl)methansulfonamide
SpectraBase Compound ID 8YyjiZFXNjZ
InChI InChI=1S/C11H6F9NO4S2/c1-6(7-2-4-8(5-3-7)9(12,13)14)21(26(22,23)10(15,16)17)27(24,25)11(18,19)20/h2-5H,1H2
InChIKey CKKPMMYHQBIQMX-UHFFFAOYSA-N
Mol Weight 451.28 g/mol
Molecular Formula C11H6F9NO4S2
Exact Mass 450.959453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jJ7VfmSe7L
Name 1,1,1-Trifluoro-N-(1-(4-(trifluoromethyl)phenyl)vinyl)-N-((trifluoromethyl)-sulfonyl)methansulfonamide
Appearance Bright brown solid
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Formula C11H6F9NO4S2
InChI InChI=1S/C11H6F9NO4S2/c1-6(7-2-4-8(5-3-7)9(12,13)14)21(26(22,23)10(15,16)17)27(24,25)11(18,19)20/h2-5H,1H2
InChIKey CKKPMMYHQBIQMX-UHFFFAOYSA-N
Instrument Name FINNIGAN SSQ
Ionization Type EI
Literature Reference DOI 10.1002/anie.201810916
Molecular Weight 451.278 g/mol
Reported Formula C11H6O4NF9S2
SMILES c1c(ccc(c1)C(=C)N(S(C(F)(F)F)(=O)=O)S(C(F)(F)F)(=O)=O)C(F)(F)F
SPLASH splash10-014i-2905000000-ec9c1ffa8d3a03c3bee5
Source of Spectrum ACI-58-SM9-5m
Wiley ID 1848170