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N-(1-([1,1'-biphenyl]-4-yl)vinyl)-1,1,1-trifluoro-N-((trifluoromethyl)sulfonyl)-methanesulfonamide
SpectraBase Compound ID 19P9iWF21ef
InChI InChI=1S/C16H11F6NO4S2/c1-11(12-7-9-14(10-8-12)13-5-3-2-4-6-13)23(28(24,25)15(17,18)19)29(26,27)16(20,21)22/h2-10H,1H2
InChIKey KJQMMXQTRURMND-UHFFFAOYSA-N
Mol Weight 459.38 g/mol
Molecular Formula C16H11F6NO4S2
Exact Mass 459.003369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILNdOMo0edx
Name N-(1-([1,1'-biphenyl]-4-yl)vinyl)-1,1,1-trifluoro-N-((trifluoromethyl)sulfonyl)-methanesulfonamide
Appearance Bright yellow solid
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Formula C16H11F6NO4S2
InChI InChI=1S/C16H11F6NO4S2/c1-11(12-7-9-14(10-8-12)13-5-3-2-4-6-13)23(28(24,25)15(17,18)19)29(26,27)16(20,21)22/h2-10H,1H2
InChIKey KJQMMXQTRURMND-UHFFFAOYSA-N
Instrument Name FINNIGAN SSQ
Ionization Type EI
Literature Reference DOI 10.1002/anie.201810916
Molecular Weight 459.377 g/mol
Reported Formula C16H11O4NF6S2
SMILES c1c(ccc(c1)C(=C)N(S(C(F)(F)F)(=O)=O)S(C(F)(F)F)(=O)=O)-c1ccccc1
SPLASH splash10-0gb9-1900000000-551ccc1561d0e5a37adc
Source of Spectrum ACI-58-SM7-5e
Wiley ID 1848163