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(1R*,2R*,4R*)-5-Bromo-8,8-dimethoxy-1-methyl-7-oxobicyclo[2.2.2]oct-5-ene-2-yl cyanide
SpectraBase Compound ID 2BW9TCiE2pi
InChI InChI=1S/C12H14BrNO3/c1-11-5-9(13)8(4-7(11)6-14)12(16-2,17-3)10(11)15/h5,7-8H,4H2,1-3H3/t7-,8-,11-/m0/s1
InChIKey QFXFGHFGJZCLOZ-LAEOZQHASA-N
Mol Weight 300.15 g/mol
Molecular Formula C12H14BrNO3
Exact Mass 299.015706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANCrhYmo8WF
Name (1R*,2R*,4R*)-5-Bromo-8,8-dimethoxy-1-methyl-7-oxobicyclo[2.2.2]oct-5-ene-2-yl cyanide
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Formula C12H14BrNO3
InChI InChI=1S/C12H14BrNO3/c1-11-5-9(13)8(4-7(11)6-14)12(16-2,17-3)10(11)15/h5,7-8H,4H2,1-3H3/t7-,8-,11-/m0/s1
InChIKey QFXFGHFGJZCLOZ-LAEOZQHASA-N
Molecular Weight 300.152 g/mol
SMILES C1([C@@]2(C(Br)=C[C@](C1=O)([C@](C#N)(C2)[H])C)[H])(OC)OC
SPLASH splash10-059x-7940000000-8fcefa205486da38a1ed
Source of Spectrum F-59-4045-4h
Wiley ID 1678070