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(1RS,2RS,5SR,1'SR)-2-[1'-(4-BROMOPHENYLSULFONYLOXY)-ETHYL]-2,4,4-TRIMETHYL-8-OXABICYCLO-[3.2.1]-OCT-6-EN-3-ONE
SpectraBase Compound ID LGVlwlKqxfA
InChI InChI=1S/C18H21BrO5S/c1-11(24-25(21,22)13-7-5-12(19)6-8-13)18(4)15-10-9-14(23-15)17(2,3)16(18)20/h5-11,14-15H,1-4H3/t11?,14-,15+,18+/m0/s1
InChIKey QUSAAXFXIUJEPK-MIOWWRDDSA-N
Mol Weight 429.33 g/mol
Molecular Formula C18H21BrO5S
Exact Mass 428.029308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GwpRR3cmBtB
Name (1RS,2RS,5SR,1'SR)-2-[1'-(4-BROMOPHENYLSULFONYLOXY)-ETHYL]-2,4,4-TRIMETHYL-8-OXABICYCLO-[3.2.1]-OCT-6-EN-3-ONE
Compound Number 15B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21BrO5S
InChI InChI=1S/C18H21BrO5S/c1-11(24-25(21,22)13-7-5-12(19)6-8-13)18(4)15-10-9-14(23-15)17(2,3)16(18)20/h5-11,14-15H,1-4H3/t11?,14-,15+,18+/m0/s1
InChIKey QUSAAXFXIUJEPK-MIOWWRDDSA-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 429.326 g/mol
Solvent CDCl3
Source File Reference UWVP6544