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3,3-Dimethoxy-5-ethanoyl-7-methoxycarbonyl-7-methylbicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID 7nv149sEFgC
InChI InChI=1S/C15H20O6/c1-8(16)9-6-10-12(17)15(20-4,21-5)11(9)7-14(10,2)13(18)19-3/h6,10-11H,7H2,1-5H3/t10-,11+,14-/m1/s1
InChIKey XXJNCSHSCBZHRO-UHIISALHSA-N
Mol Weight 296.32 g/mol
Molecular Formula C15H20O6
Exact Mass 296.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CaEqABR2IuZ
Name 3,3-Dimethoxy-5-ethanoyl-7-methoxycarbonyl-7-methylbicyclo[2.2.2]oct-5-en-2-one
Alternate Name(s) (1R*,4S*,7S*)-3,3-Dimethoxy-5-ethanoyl-7-methoxycarbonyl-7-methylbicyclo[2.2.2]oct-5-en-2-one methyl 5-acetyl-8,8-dimethoxy-2-methyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O6
InChI InChI=1S/C15H20O6/c1-8(16)9-6-10-12(17)15(20-4,21-5)11(9)7-14(10,2)13(18)19-3/h6,10-11H,7H2,1-5H3/t10-,11+,14-/m1/s1
InChIKey XXJNCSHSCBZHRO-UHIISALHSA-N
Molecular Weight 296.319 g/mol
SMILES C1([C@@]2(C(C(=O)C)=C[C@](C1=O)([C@@](C(=O)OC)(C)C2)[H])[H])(OC)OC
SPLASH splash10-0a4i-0090000000-490a511e520e7fe98244
Source of Spectrum J-64-4109-17
Wiley ID 1530307