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METHYL-(1-alpha,2-alpha,3-alpha,6-alpha,7-alpha)-7-BROMO-2,3-DIHYDROXY-BICYCLO-[4.1.0]-HEPT-4-ENE-7-CARBOXYLATE
SpectraBase Compound ID 5OFppY7bj6s
InChI InChI=1S/C9H11BrO4/c1-14-8(13)9(10)4-2-3-5(11)7(12)6(4)9/h2-7,11-12H,1H3/t4-,5-,6-,7-,9+/m0/s1
InChIKey LGYOMXPJIBLLEE-GOXFSFIGSA-N
Mol Weight 263.09 g/mol
Molecular Formula C9H11BrO4
Exact Mass 261.984072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 86yxguRbU
Name Methyl (1.alpha.,2.alpha.,6.alpha.,7.alpha.)-7-Bromo-2,3-dihydroxy-bicyclo[4.1.0]hept-4-ene-7-carboxylate
Alternate Name(s) Methyl (1.alpha.,2.alpha.,6.alpha.,7.alpha.)-7-Bromo-2,3-dihydrobicyclo[4.1.0]hept-4-ene-7-carboxylate Methyl (1S,4S,5R,6S,7R)-7-bromo-4,5-dihydroxybicyclo[4.1.0]hept-2-ene-7-carboxylate
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Formula C9H11BrO4
InChI InChI=1S/C9H11BrO4/c1-14-8(13)9(10)4-2-3-5(11)7(12)6(4)9/h2-7,11-12H,1H3/t4-,5-,6-,7-,9+/m0/s1
InChIKey LGYOMXPJIBLLEE-GOXFSFIGSA-N
Molecular Weight 263.087 g/mol
SMILES O[C@]1(C=C[C@@]2([C@@]([C@@]2([C@]1(O)[H])[H])(C(=O)OC)Br)[H])[H]
SPLASH splash10-00or-9800000000-02d7219c408fc47a8d93
Source of Spectrum KC-1993-1917-12
Wiley ID 778543