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Methyl (1S*,2S*,4R*)-5-Bromo-8,8-dimethoxy-1,2-dimethyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate
SpectraBase Compound ID EN6xikFH45H
InChI InChI=1S/C14H19BrO5/c1-12-7-9(15)8(6-13(12,2)11(17)18-3)14(19-4,20-5)10(12)16/h7-8H,6H2,1-5H3/t8-,12+,13+/m0/s1
InChIKey ARKJNMOMDONGHG-ZEGGKSINSA-N
Mol Weight 347.21 g/mol
Molecular Formula C14H19BrO5
Exact Mass 346.041587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5c8sbb6HVRc
Name Methyl (1S*,2S*,4R*)-5-Bromo-8,8-dimethoxy-1,2-dimethyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate
Alternate Name(s) Methyl (1S,2S,4R)-5-bromo-8,8-dimethoxy-1,2-dimethyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate
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Formula C14H19BrO5
InChI InChI=1S/C14H19BrO5/c1-12-7-9(15)8(6-13(12,2)11(17)18-3)14(19-4,20-5)10(12)16/h7-8H,6H2,1-5H3/t8-,12+,13+/m0/s1
InChIKey ARKJNMOMDONGHG-ZEGGKSINSA-N
Molecular Weight 347.205 g/mol
SMILES [C@@]12([C@](C[C@](C(=C2)Br)([H])C(C1=O)(OC)OC)(C(=O)OC)C)C
SPLASH splash10-06dr-1189000000-87d3140a46151b448b69
Source of Spectrum J-67-6500-26
Wiley ID 1570847