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6,6-DIMETHYL-4,4,8,8-TETRAKIS-(TRIFLUOROMETHYL)-1,5-DIAZABICYCLO-[3.3.0]-OCTANE-2-CARBONITRILE
SpectraBase Compound ID 9MaZHe2VHHh
InChI InChI=1S/C13H11F12N3/c1-7(2)5-9(12(20,21)22,13(23,24)25)27-6(4-26)3-8(28(7)27,10(14,15)16)11(17,18)19/h6H,3,5H2,1-2H3
InChIKey TTYVVEHUFIGQGA-UHFFFAOYSA-N
Mol Weight 437.23 g/mol
Molecular Formula C13H11F12N3
Exact Mass 437.076135 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITXJyqgKDWa
Name 6,6-DIMETHYL-4,4,8,8-TETRAKIS-(TRIFLUOROMETHYL)-1,5-DIAZABICYCLO-[3.3.0]-OCTANE-2-CARBONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11F12N3
InChI InChI=1S/C13H11F12N3/c1-7(2)5-9(12(20,21)22,13(23,24)25)27-6(4-26)3-8(28(7)27,10(14,15)16)11(17,18)19/h6H,3,5H2,1-2H3
InChIKey TTYVVEHUFIGQGA-UHFFFAOYSA-N
Literature Reference Author K.BURGER,H.SCHICKANEDER,W.THENN,G.EBNER,C.ZETTL
Literature Reference Citation LIEB.ANN.CHEM.,2156(1976)
Literature Reference DOI 10.1002/jlac.197619761203
Solvent CDCl3
Source File Reference UWPS202