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(+/-)-9B-BrOMO-7,7-DIMETHYL-1,3-DIOXO-1,3,3A,4,6,7,9A,9B-OCTAHYDROBENZO-[E]-ISOBENZOFURAN-9-YL-ACETATE
SpectraBase Compound ID e9tJGckeIM
InChI InChI=1S/C16H17BrO5/c1-8(18)21-11-7-15(2,3)6-9-4-5-10-13(19)22-14(20)16(10,17)12(9)11/h4,7,10,12H,5-6H2,1-3H3/t10-,12?,16-/m0/s1
InChIKey ZPSPWHNKIRNAFV-FYWHMBHGSA-N
Mol Weight 369.21 g/mol
Molecular Formula C16H17BrO5
Exact Mass 368.025937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D42grelAhHk
Name (+/-)-9B-BrOMO-7,7-DIMETHYL-1,3-DIOXO-1,3,3A,4,6,7,9A,9B-OCTAHYDROBENZO-[E]-ISOBENZOFURAN-9-YL-ACETATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17BrO5
InChI InChI=1S/C16H17BrO5/c1-8(18)21-11-7-15(2,3)6-9-4-5-10-13(19)22-14(20)16(10,17)12(9)11/h4,7,10,12H,5-6H2,1-3H3/t10-,12?,16-/m0/s1
InChIKey ZPSPWHNKIRNAFV-FYWHMBHGSA-N
Literature Reference Author M.A.APPONYI,J.H.BOWIE,B.W.SKELTON,A.H.WHITE
Literature Reference Citation AUSTR.J.CHEM.,55,343(2002)
Literature Reference DOI 10.1071/CH02040
Molecular Weight 369.212 g/mol
Solvent CDCl3
Source File Reference UWKP3322