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1,4,5-TRIMETHYL-3-PERFLUOROOCTYL-1,2,4-TRIAZOLIUM-BIS-(TRIFLUOROMETHANESULFONYL)-AMIDE

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1,4,5-TRIMETHYL-3-PERFLUOROOCTYL-1,2,4-TRIAZOLIUM-BIS-(TRIFLUOROMETHANESULFONYL)-AMIDE
SpectraBase Compound ID T6FBgNLH9N
InChI InChI=1S/C13H9F17N3.C2F6NO4S2/c1-4-32(2)5(31-33(4)3)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)30;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h1-3H3;/q+1;-1
InChIKey VPHGETOTTILFRI-UHFFFAOYSA-N
Mol Weight 810.34 g/mol
Molecular Formula C15H9F23N4O4S2
Exact Mass 809.969795 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPhbvphirMF
Name 1,4,5-TRIMETHYL-3-PERFLUOROOCTYL-1,2,4-TRIAZOLIUM-BIS-(TRIFLUOROMETHANESULFONYL)-AMIDE
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H9F23N4O4S2
InChI InChI=1S/C13H9F17N3.C2F6NO4S2/c1-4-32(2)5(31-33(4)3)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)30;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h1-3H3;/q+1;-1
InChIKey VPHGETOTTILFRI-UHFFFAOYSA-N
Literature Reference Author H.XUE,B.TWAMLEY,J.M.SHREEVE
Literature Reference Citation J.ORG.CHEM.,69,1397(2004)
Literature Reference DOI 10.1021/jo0356107
Solvent Unknown
Source File Reference UWVN21879