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BIS-(7-OXO-2,4,5,6,8-PENTAMETHYL-2,4,6,8-TETRAAZABICYCLO-[3.3.0]-OCTANE-3-YLIUM)-ETHER-BIS-(TRIFLUOROMETHANESULFONATE)
SpectraBase Compound ID KgW2rKzYpJj
InChI InChI=1S/C18H34N8O3.2CHF3O3S/c1-17-11(19(3)13(27)23(17)7)21(5)15(25(17)9)29-16-22(6)12-18(2,26(16)10)24(8)14(28)20(12)4;2*2-1(3,4)8(5,6)7/h11-12,15-16H,1-10H3;2*(H,5,6,7)/p-2
InChIKey LZBJMJKQPCVRNM-UHFFFAOYSA-L
Mol Weight 708.65 g/mol
Molecular Formula C20H34F6N8O9S2
Exact Mass 708.179436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CeaKJSiwLUV
Name BIS-(7-OXO-2,4,5,6,8-PENTAMETHYL-2,4,6,8-TETRAAZABICYCLO-[3.3.0]-OCTANE-3-YLIUM)-ETHER-BIS-(TRIFLUOROMETHANESULFONATE)
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34F6N8O9S2
InChI InChI=1S/C18H34N8O3.2CHF3O3S/c1-17-11(19(3)13(27)23(17)7)21(5)15(25(17)9)29-16-22(6)12-18(2,26(16)10)24(8)14(28)20(12)4;2*2-1(3,4)8(5,6)7/h11-12,15-16H,1-10H3;2*(H,5,6,7)/p-2
InChIKey LZBJMJKQPCVRNM-UHFFFAOYSA-L
Literature Reference Author G.MAAS,R.BRUECKMANN,B.FEITH
Literature Reference Citation J.HETCYCL.CHEM.,22,907(1985)
Literature Reference DOI 10.1002/jhet.5570220358
Molecular Weight 708.649 g/mol
Solvent CD3CN
Source File Reference UWCS11081