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5-ENDO-([(TERT.-BUTYLDIMETHYLSILYL)-OXY]-METHYL)-2-(4'-METHYLBENZENESULFONYL)-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-7-ENE
SpectraBase Compound ID EmaLEzDirWO
InChI InChI=1S/C21H31NO4SSi/c1-15-7-10-18(11-8-15)27(24,25)22-17-9-12-19(20(22)23)16(13-17)14-26-28(5,6)21(2,3)4/h7-12,16-17,19H,13-14H2,1-6H3/t16-,17+,19-/m0/s1
InChIKey WVFGLAHYPRDJTE-SCTDSRPQSA-N
Mol Weight 421.63 g/mol
Molecular Formula C21H31NO4SSi
Exact Mass 421.174306 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HISy0gpS8mC
Name 5-ENDO-([(TERT.-BUTYLDIMETHYLSILYL)-OXY]-METHYL)-2-(4'-METHYLBENZENESULFONYL)-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-7-ENE
CAS Registry Number 141667-51-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31NO4SSi
InChI InChI=1S/C21H31NO4SSi/c1-15-7-10-18(11-8-15)27(24,25)22-17-9-12-19(20(22)23)16(13-17)14-26-28(5,6)21(2,3)4/h7-12,16-17,19H,13-14H2,1-6H3/t16-,17+,19-/m0/s1
InChIKey WVFGLAHYPRDJTE-SCTDSRPQSA-N
Literature Reference Author G.H.POSNER,V.VINADER,K.AFARINKIA
Literature Reference Citation J.ORG.CHEM.,57,4088(1992)
Literature Reference DOI 10.1021/jo00041a010
Molecular Weight 421.627 g/mol
Solvent CDCl3
Source File Reference UWCS3843