For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl (1S*,2S*,4R*)-5-Bromo-8,8-dimethoxy-1-methyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate
SpectraBase Compound ID 6BXfCPWudzP
InChI InChI=1S/C13H17BrO5/c1-12-6-9(14)7(5-8(12)10(15)17-2)13(18-3,19-4)11(12)16/h6-8H,5H2,1-4H3/t7-,8+,12+/m0/s1
InChIKey LYVJLAMJPLRXOX-JOAULVNJSA-N
Mol Weight 333.18 g/mol
Molecular Formula C13H17BrO5
Exact Mass 332.025937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9OOeG4KuNFs
Name Methyl (1S*,2S*,4R*)-5-Bromo-8,8-dimethoxy-1-methyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate
Alternate Name(s) Methyl (1S,2S,4R)-5-bromo-8,8-dimethoxy-1-methyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BrO5
InChI InChI=1S/C13H17BrO5/c1-12-6-9(14)7(5-8(12)10(15)17-2)13(18-3,19-4)11(12)16/h6-8H,5H2,1-4H3/t7-,8+,12+/m0/s1
InChIKey LYVJLAMJPLRXOX-JOAULVNJSA-N
Molecular Weight 333.178 g/mol
SMILES [C@]12(C(C(OC)(OC)[C@](C[C@@]2(C(=O)OC)[H])([H])C(=C1)Br)=O)C
SPLASH splash10-056r-1093000000-6dd204d6563cbc185a35
Source of Spectrum J-67-6500-26
Wiley ID 1570848