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4-(Benzyloxy)-5-endo-[(tert-butyldimethylsilyloxy)methyl]-2-(4'-methylbenzenesulfonyl)-3-oxo-2-azabicyclo[2.2.2]-7-octene
SpectraBase Compound ID JeeZBhIvZp5
InChI InChI=1S/C28H37NO5SSi/c1-21-12-14-25(15-13-21)35(31,32)29-24-16-17-28(26(29)30,33-19-22-10-8-7-9-11-22)23(18-24)20-34-36(5,6)27(2,3)4/h7-17,23-24H,18-20H2,1-6H3
InChIKey QSHKYXWBSFQZFW-UHFFFAOYSA-N
Mol Weight 527.8 g/mol
Molecular Formula C28H37NO5SSi
Exact Mass 527.216171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A12q1RJzvRd
Name 4-(Benzyloxy)-5-endo-[(tert-butyldimethylsilyloxy)methyl]-2-(4'-methylbenzenesulfonyl)-3-oxo-2-azabicyclo[2.2.2]-7-octene
Alternate Name(s) 4-(benzyloxy)-8-({[tert-butyl(dimethyl)silyl]oxy}methyl)-2-[(4-methylphenyl)sulfonyl]-2-azabicyclo[2.2.2]oct-5-en-3-one
CAS Registry Number 141667-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H37NO5SSi
InChI InChI=1S/C28H37NO5SSi/c1-21-12-14-25(15-13-21)35(31,32)29-24-16-17-28(26(29)30,33-19-22-10-8-7-9-11-22)23(18-24)20-34-36(5,6)27(2,3)4/h7-17,23-24H,18-20H2,1-6H3
InChIKey QSHKYXWBSFQZFW-UHFFFAOYSA-N
Molecular Weight 527.751 g/mol
SMILES c1(S(N2C(C3(OCc4ccccc4)C(CC2C=C3)CO[Si](C(C)(C)C)(C)C)=O)(=O)=O)ccc(cc1)C
SPLASH splash10-03dl-4910000000-9c771e4d05c207208701
Source of Spectrum J-57-4097-9
Wiley ID 1402960