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Methyl 7-bromo-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-5(exo)-carboxylate
SpectraBase Compound ID 6AbXIxo2qNM
InChI InChI=1S/C9H9BrO4/c1-13-8(11)5-3-7-6(10)2-4(5)9(12)14-7/h2,4-5,7H,3H2,1H3/t4-,5?,7-/m0/s1
InChIKey SPKCWPMBBRNBNO-VZWBMFKNSA-N
Mol Weight 261.07 g/mol
Molecular Formula C9H9BrO4
Exact Mass 259.968422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdKQtb19ukh
Name Methyl 7-bromo-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-5(exo)-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9BrO4
InChI InChI=1S/C9H9BrO4/c1-13-8(11)5-3-7-6(10)2-4(5)9(12)14-7/h2,4-5,7H,3H2,1H3/t4-,5?,7-/m0/s1
InChIKey SPKCWPMBBRNBNO-VZWBMFKNSA-N
Molecular Weight 261.071 g/mol
SMILES C1([C@]2(C=C([C@@](O1)(CC2C(=O)OC)[H])Br)[H])=O
SPLASH splash10-0a4i-3940000000-42b0c0ef4c04a9746bf6
Source of Spectrum F-70-1133-0
Synonyms Methyl 7-bromo-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-5(endo)-carboxylate Methyl 7-bromo-3-oxo-2-oxabicyclo[2.2.2]oct-7-ene-5-carboxylate
Wiley ID 1596206