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2-Butyl-1-ethyl-3-methylimidazolium-triflimide
SpectraBase Compound ID 3IrwKxwokGb
InChI InChI=1S/C10H19N2.C2F6NO4S2/c1-4-6-7-10-11(3)8-9-12(10)5-2;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h8-9H,4-7H2,1-3H3;/q+1;-1
InChIKey WEORYIAFUBEUIX-UHFFFAOYSA-N
Mol Weight 447.41 g/mol
Molecular Formula C12H19F6N3O4S2
Exact Mass 447.072117 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C6DuWulZo1i
Name 2-Butyl-1-ethyl-3-methylimidazolium-triflimide
Comments Computed using HOSE algorithm
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Exact Mass 447.072117426 u
Formula C12H19F6N3O4S2
InChI InChI=1S/C10H19N2.C2F6NO4S2/c1-4-6-7-10-11(3)8-9-12(10)5-2;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h8-9H,4-7H2,1-3H3;/q+1;-1
InChIKey WEORYIAFUBEUIX-UHFFFAOYSA-N
Molecular Weight 447.411 g/mol
SMILES C(S([N-]S(=O)(=O)C(F)(F)F)(=O)=O)(F)(F)F.C=1(N(C=C[N+]1CC)C)CCCC