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3,3-Dimethoxy-7-ethanoyl-5-methoxycarbonylbicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID E2rHbHDzLv6
InChI InChI=1S/C14H18O6/c1-7(15)8-6-11-10(13(17)18-2)5-9(8)12(16)14(11,19-3)20-4/h5,8-9,11H,6H2,1-4H3/t8?,9-,11-/m0/s1
InChIKey JFXDTMCHXBRULV-PCFYAGROSA-N
Mol Weight 282.29 g/mol
Molecular Formula C14H18O6
Exact Mass 282.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EREywaC7B6W
Name 3,3-Dimethoxy-7-ethanoyl-5-methoxycarbonylbicyclo[2.2.2]oct-5-en-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H18O6
InChI InChI=1S/C14H18O6/c1-7(15)8-6-11-10(13(17)18-2)5-9(8)12(16)14(11,19-3)20-4/h5,8-9,11H,6H2,1-4H3/t8?,9-,11-/m0/s1
InChIKey JFXDTMCHXBRULV-PCFYAGROSA-N
Molecular Weight 282.292 g/mol
SMILES C1([C@@]2(C(C(=O)OC)=C[C@](C1=O)(C(C(=O)C)C2)[H])[H])(OC)OC
SPLASH splash10-0006-9010000000-884b9974ac763a1112b3
Source of Spectrum J-64-4109-16
Synonyms (1R*,4S*,7S*)-3,3-Dimethoxy-7-ethanoyl-5-methoxycarbonylbicyclo[2.2.2]oct-5-en-2-one methyl 8-acetyl-6,6-dimethoxy-5-oxobicyclo[2.2.2]oct-2-ene-2-carboxylate
Wiley ID 1530309