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4-HYDROXY-5-ENDO-([(TERT.-BUTYLDIMETHYLSILYL)-OXY]-METHYL)-2-(4'-METHYLBENZENESULFONYL)-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-7-ENE

View entire compound with spectra: 1 NMR

4-HYDROXY-5-ENDO-([(TERT.-BUTYLDIMETHYLSILYL)-OXY]-METHYL)-2-(4'-METHYLBENZENESULFONYL)-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-7-ENE
SpectraBase Compound ID BpJpDSHCIyX
InChI InChI=1S/C21H31NO5SSi/c1-15-7-9-18(10-8-15)28(25,26)22-17-11-12-21(24,19(22)23)16(13-17)14-27-29(5,6)20(2,3)4/h7-12,16-17,24H,13-14H2,1-6H3/t16-,17+,21+/m1/s1
InChIKey ASVMSDPZCJUBJV-WWMYMODYSA-N
Mol Weight 437.63 g/mol
Molecular Formula C21H31NO5SSi
Exact Mass 437.169221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4HqO8NyZejT
Name 4-HYDROXY-5-ENDO-([(TERT.-BUTYLDIMETHYLSILYL)-OXY]-METHYL)-2-(4'-METHYLBENZENESULFONYL)-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-7-ENE
CAS Registry Number 141667-53-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31NO5SSi
InChI InChI=1S/C21H31NO5SSi/c1-15-7-9-18(10-8-15)28(25,26)22-17-11-12-21(24,19(22)23)16(13-17)14-27-29(5,6)20(2,3)4/h7-12,16-17,24H,13-14H2,1-6H3/t16-,17+,21+/m1/s1
InChIKey ASVMSDPZCJUBJV-WWMYMODYSA-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 437.626 g/mol
Solvent CDCl3
Source File Reference UWCS3846