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2-(Thianthren-2-yl)-2,3-diaza-bicyclo(2.2.2)oct-2-en-2-yl cation
SpectraBase Compound ID 9QLmPl9uOGm
InChI InChI=1S/C18H17N2S2/c1-2-4-16-15(3-1)21-17-10-9-14(11-18(17)22-16)20-13-7-5-12(19-20)6-8-13/h1-4,9-13H,5-8H2/q+1/t12-,13+
InChIKey IODVMDODSMNVRJ-BETUJISGSA-N
Mol Weight 325.47 g/mol
Molecular Formula C18H17N2S2
Exact Mass 325.083316 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HULiLc24cF
Name 2-(Thianthren-2-yl)-2,3-diaza-bicyclo(2.2.2)oct-2-en-2-yl cation
Comments ANION CLO4-
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Formula C18H17N2S2
InChI InChI=1S/C18H17N2S2/c1-2-4-16-15(3-1)21-17-10-9-14(11-18(17)22-16)20-13-7-5-12(19-20)6-8-13/h1-4,9-13H,5-8H2/q+1/t12-,13+
InChIKey IODVMDODSMNVRJ-BETUJISGSA-N
Literature Reference P.S. Engel, A.K. Hoque, J.N.Scholz, J. Am. Chem. Soc. 110, 7880 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2