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6-FLUORO-3-(8-METHYL-3,8-DIAZABICYCLO-[3.2.1]-OCTAN-3-YL)-DIBENZO-[B,D]-THIOPHENE-5,5-DIOXIDE
SpectraBase Compound ID KYN16nhgOZe
InChI InChI=1S/C19H19FN2O2S/c1-21-13-5-6-14(21)11-22(10-13)12-7-8-15-16-3-2-4-17(20)19(16)25(23,24)18(15)9-12/h2-4,7-9,13-14H,5-6,10-11H2,1H3/t13-,14-/m1/s1
InChIKey YPMCGRXCKDPHNO-ZIAGYGMSSA-N
Mol Weight 358.43 g/mol
Molecular Formula C19H19FN2O2S
Exact Mass 358.115127 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CHZDkMCA4kL
Name 6-FLUORO-3-(8-METHYL-3,8-DIAZABICYCLO-[3.2.1]-OCTAN-3-YL)-DIBENZO-[B,D]-THIOPHENE-5,5-DIOXIDE
Compound Number 13 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H19FN2O2S
InChI InChI=1S/C19H19FN2O2S/c1-21-13-5-6-14(21)11-22(10-13)12-7-8-15-16-3-2-4-17(20)19(16)25(23,24)18(15)9-12/h2-4,7-9,13-14H,5-6,10-11H2,1H3/t13-,14-/m1/s1
InChIKey YPMCGRXCKDPHNO-ZIAGYGMSSA-N
Literature Reference Author R.TEODORO,M.SCHEUNEMANN,W.DEUTHER-CONRAD,B.WENZEL,F.M.FASOLI ,C.GOTTI,M.KRANZ,C.K
Literature Reference Citation MOLECULES,20,18387(2015)
Literature Reference DOI 10.3390/molecules201018387
Solvent CDCl3
Source File Reference UWPA5231