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6-(2,6-DINITRO-alpha,alpha,alpha-TRIFLUORO-p-TOLYL)-1,3,3-TRIMETHYL-6-AZABICYCLO[3.2.1]OCTANE
SpectraBase Compound ID Aw96c1NnWZ8
InChI InChI=1S/C17H20F3N3O4/c1-15(2)6-11-7-16(3,8-15)9-21(11)14-12(22(24)25)4-10(17(18,19)20)5-13(14)23(26)27/h4-5,11H,6-9H2,1-3H3
InChIKey LYMLVKGSIPSIKF-UHFFFAOYSA-N
Mol Weight 387.36 g/mol
Molecular Formula C17H20F3N3O4
Exact Mass 387.140591 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4O1WcToAseW
Name 6-(2,6-dinitro-alpha,alpha,alpha-trifluoro-p-tolyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane
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Formula C17H20F3N3O4
InChI InChI=1S/C17H20F3N3O4/c1-15(2)6-11-7-16(3,8-15)9-21(11)14-12(22(24)25)4-10(17(18,19)20)5-13(14)23(26)27/h4-5,11H,6-9H2,1-3H3
InChIKey LYMLVKGSIPSIKF-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 33467M
Solvent CDCl3