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(-)-(1S,6R)-3-Bromo-8,8-dimethyl-4-oxo-7,9-dioxabicyclo[4.3.0]non-2-ene
SpectraBase Compound ID B2gg9iLmg9d
InChI InChI=1S/C9H11BrO3/c1-9(2)12-7-3-5(10)6(11)4-8(7)13-9/h3,7-8H,4H2,1-2H3/t7-,8+/m0/s1
InChIKey GMFPUAKVPGTSLG-JGVFFNPUSA-N
Mol Weight 247.09 g/mol
Molecular Formula C9H11BrO3
Exact Mass 245.989157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dONen01wW
Name (-)-(1S,6R)-3-Bromo-8,8-dimethyl-4-oxo-7,9-dioxabicyclo[4.3.0]non-2-ene
Alternate Name(s) (3aR,7aS)-6-bromanyl-2,2-dimethyl-4,7a-dihydro-3aH-1,3-benzodioxol-5-one
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Formula C9H11BrO3
InChI InChI=1S/C9H11BrO3/c1-9(2)12-7-3-5(10)6(11)4-8(7)13-9/h3,7-8H,4H2,1-2H3/t7-,8+/m0/s1
InChIKey GMFPUAKVPGTSLG-JGVFFNPUSA-N
Molecular Weight 247.088 g/mol
SMILES C1=C(C(=O)C[C@]2(OC(O[C@@]12[H])(C)C)[H])Br
SPLASH splash10-01p2-0960000000-9b209f1680bba9ec3375
Source of Spectrum J-59-5607-47
Wiley ID 1249722