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TERT.-BUTYL-(1S,8R,10S)-10-[2-(PHENYLSULFONYL)-ETHYL]-9-AZATRICYCLO-[6.2.1.0(2,7)]-UNDECA-2,4,6-TRIENE-9-CARBOXYLATE
SpectraBase Compound ID KhEWF7fqbiR
InChI InChI=1S/C23H27NO4S/c1-23(2,3)28-22(25)24-20(13-14-29(26,27)16-9-5-4-6-10-16)19-15-21(24)18-12-8-7-11-17(18)19/h4-12,19-21H,13-15H2,1-3H3/t19-,20+,21+/m0/s1
InChIKey JIVYDCHVXILRAE-PWRODBHTSA-N
Mol Weight 413.53 g/mol
Molecular Formula C23H27NO4S
Exact Mass 413.16608 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BkU7cZB2tzs
Name TERT.-BUTYL-(1S,8R,10S)-10-[2-(PHENYLSULFONYL)-ETHYL]-9-AZATRICYCLO-[6.2.1.0(2,7)]-UNDECA-2,4,6-TRIENE-9-CARBOXYLATE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27NO4S
InChI InChI=1S/C23H27NO4S/c1-23(2,3)28-22(25)24-20(13-14-29(26,27)16-9-5-4-6-10-16)19-15-21(24)18-12-8-7-11-17(18)19/h4-12,19-21H,13-15H2,1-3H3/t19-,20+,21+/m0/s1
InChIKey JIVYDCHVXILRAE-PWRODBHTSA-N
Literature Reference Author D.M.HODGSON,L.H.WINNING
Literature Reference Citation BEIL.J.ORG.CHEM.,4,38,1(2008)
Molecular Weight 413.532 g/mol
Solvent CDCl3
Source File Reference UWBT10690