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(1S*,4R*)-1,3,3-Trimethyl-5-acetoxy-7-ethoxycarbonylbicyclo[2.2.2]octa-5,7-diene-2-one
SpectraBase Compound ID 7GpA1YRyOrt
InChI InChI=1S/C16H20O5/c1-6-20-13(18)11-7-10-12(21-9(2)17)8-16(11,5)14(19)15(10,3)4/h7-8,10H,6H2,1-5H3/t10-,16-/m0/s1
InChIKey WLLXXKRTDHJILR-QFYYESIMSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DljVipwEGrZ
Name (1S*,4R*)-1,3,3-Trimethyl-5-acetoxy-7-ethoxycarbonylbicyclo[2.2.2]octa-5,7-diene-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-6-20-13(18)11-7-10-12(21-9(2)17)8-16(11,5)14(19)15(10,3)4/h7-8,10H,6H2,1-5H3/t10-,16-/m0/s1
InChIKey WLLXXKRTDHJILR-QFYYESIMSA-N
Molecular Weight 292.331 g/mol
SMILES [C@@]12(C(=C[C@@](C(=C2)OC(=O)C)(C(C1=O)(C)C)[H])C(=O)OCC)C
SPLASH splash10-00di-9410000000-74479cc6133c4020bf04
Source of Spectrum F-69-453-6
Synonyms Ethyl 5-(acetyloxy)-1,8,8-trimethyl-7-oxobicyclo[2.2.2]octa-2,5-diene-2-carboxylate
Wiley ID 1594561