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3,3-Dimethoxy-5,7-bis(methoxycarbonyl)-7-methylbicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID IokyDx118cZ
InChI InChI=1S/C15H20O7/c1-14(13(18)20-3)7-10-8(12(17)19-2)6-9(14)11(16)15(10,21-4)22-5/h6,9-10H,7H2,1-5H3/t9-,10+,14-/m1/s1
InChIKey AEWHYDKQNQHNMJ-ISTVAULSSA-N
Mol Weight 312.32 g/mol
Molecular Formula C15H20O7
Exact Mass 312.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Q94LA36eG3
Name 3,3-Dimethoxy-5,7-bis(methoxycarbonyl)-7-methylbicyclo[2.2.2]oct-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O7
InChI InChI=1S/C15H20O7/c1-14(13(18)20-3)7-10-8(12(17)19-2)6-9(14)11(16)15(10,21-4)22-5/h6,9-10H,7H2,1-5H3/t9-,10+,14-/m1/s1
InChIKey AEWHYDKQNQHNMJ-ISTVAULSSA-N
Molecular Weight 312.318 g/mol
SMILES C1([C@@]2(C(C(=O)OC)=C[C@](C1=O)([C@@](C(=O)OC)(C)C2)[H])[H])(OC)OC
SPLASH splash10-0059-0090000000-9592e06623a2610f4fdf
Source of Spectrum J-64-4108-16
Synonyms (1R*,4S*,7S*)-3,3-Dimethoxy-5,7-bis(methoxycarbonyl)-7-methylbicyclo[2.2.2]oct-5-en-2-one Dimethyl 7,7-dimethoxy-5-methyl-8-oxobicyclo[2.2.2]oct-2-ene-2,5-dicarboxylate
Wiley ID 1530310