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(1-alpha,5-alpha,6-alpha)-3-ACETOXY-7,7-DIBROMO-4,5-DIMETHOXY-BICYCLO-[4.1.0]-HEPTEN-2-ONE
SpectraBase Compound ID BSK7jYk13Gw
InChI InChI=1S/C11H12Br2O5/c1-4(14)18-9-7(15)5-6(11(5,12)13)8(16-2)10(9)17-3/h5-6,8H,1-3H3/t5-,6+,8-/m1/s1
InChIKey GQFWZVAOOVBHPQ-GKROBHDKSA-N
Mol Weight 384.02 g/mol
Molecular Formula C11H12Br2O5
Exact Mass 381.905149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EKwJQOn877
Name (1.alpha.,5.alpha.,6.alpha.)-3-Acetoxy-7,7-dibromo-4,5-dimethoxybicyclo[4.1.0]hept-3-ene-2-one
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Formula C11H12Br2O5
InChI InChI=1S/C11H12Br2O5/c1-4(14)18-9-7(15)5-6(11(5,12)13)8(16-2)10(9)17-3/h5-6,8H,1-3H3/t5-,6+,8-/m1/s1
InChIKey GQFWZVAOOVBHPQ-GKROBHDKSA-N
Molecular Weight 384.020 g/mol
SMILES [C@@]12([C@]([C@@](OC)(C(=C(C2=O)OC(=O)C)OC)[H])([H])C1(Br)Br)[H]
SPLASH splash10-0006-9062000000-a437449cedbb49f6075a
Source of Spectrum KC-1993-1919-27
Synonyms (1.alpha.,5.alpha.,6.alpha.,7.alpha.)-3-Acetoxy-7,7-dibromo-4,5-dimethoxybicyclo[4.1.0]hept-3-ene-2-one (1R,5R,6S)-7,7-dibromo-4,5-dimethoxy-2-oxobicyclo[4.1.0]hept-3-en-3-yl acetate Acetic acid (1R,5R,6S)-7,7-dibromo-4,5-dimethoxy-2-oxo-bicyclo[4.1.0]hept-3-en-3-yl ester Acetic acid[(1S,2R,6R)-7,7-dibromo-2,3-dimethoxy-5-oxo-4-bicyclo[4.1.0]hept-3-enyl]ester Acetic acid[(1S,2R,6R)-7,7-dibromo-5-keto-2,3-dimethoxy-4-bicyclo[4.1.0]hept-3-enyl]ester [(1S,2R,6R)-7,7-bis(bromanyl)-2,3-dimethoxy-5-oxidanylidene-4-bicyclo[4.1.0]hept-3-enyl]ethanoate [(1S,2R,6R)-7,7-dibromo-2,3-dimethoxy-5-oxo-4-bicyclo[4.1.0]hept-3-enyl]acetate Acetic acid [(1S,2R,6R)-7,7-dibromo-2,3-dimethoxy-5-oxo-4-bicyclo[4.1.0]hept-3-enyl] ester [(1S,2R,6R)-7,7-dibromo-2,3-dimethoxy-5-oxo-4-bicyclo[4.1.0]hept-3-enyl] acetate [(1S,2R,6R)-7,7-bis(bromanyl)-2,3-dimethoxy-5-oxidanylidene-4-bicyclo[4.1.0]hept-3-enyl] ethanoate
Wiley ID 778537