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(1RS,4SR,5SR,1'RS)-4-[1'-(4-BROMOPHENYLSULFONYLOXY)-ETHYL]-2,2-DIMETHYL-8-OXABICYCLO-[3.2.1]-OCT-6-EN-3-ONE
SpectraBase Compound ID 4acrdMxj72B
InChI InChI=1S/C17H19BrO5S/c1-10(23-24(20,21)12-6-4-11(18)5-7-12)15-13-8-9-14(22-13)17(2,3)16(15)19/h4-10,13-15H,1-3H3/t10?,13-,14+,15-/m0/s1
InChIKey ZYUHQBWMCSECQR-ZRLZJUFWSA-N
Mol Weight 415.3 g/mol
Molecular Formula C17H19BrO5S
Exact Mass 414.013658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1fCIvyNKu2N
Name (1RS,4SR,5SR,1'RS)-4-[1'-(4-BROMOPHENYLSULFONYLOXY)-ETHYL]-2,2-DIMETHYL-8-OXABICYCLO-[3.2.1]-OCT-6-EN-3-ONE
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H19BrO5S
InChI InChI=1S/C17H19BrO5S/c1-10(23-24(20,21)12-6-4-11(18)5-7-12)15-13-8-9-14(22-13)17(2,3)16(15)19/h4-10,13-15H,1-3H3/t10?,13-,14+,15-/m0/s1
InChIKey ZYUHQBWMCSECQR-ZRLZJUFWSA-N
Literature Reference Author I.STOHRER,H.M.R.HOFFMANN
Literature Reference Citation HELV.CHIM.ACTA,76,2194(1993)
Literature Reference DOI 10.1002/hlca.19930760604
Molecular Weight 415.299 g/mol
Solvent CDCl3
Source File Reference UWVP6545