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5-Acetoxy-1,3,8,8-tetramethyl-7-oxo-bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid methyl ester
SpectraBase Compound ID 1cTWpmYyHFg
InChI InChI=1S/C16H20O5/c1-8-11-10(21-9(2)17)7-16(5,12(8)13(18)20-6)14(19)15(11,3)4/h7,11H,1-6H3/t11-,16-/m0/s1
InChIKey QGVGIOJRXMISBH-ZBEGNZNMSA-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 3HFSVb9NyC9
Name 5-Acetoxy-1,3,8,8-tetramethyl-7-oxo-bicyclo[2.2.2]octa-2,5-diene-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-8-11-10(21-9(2)17)7-16(5,12(8)13(18)20-6)14(19)15(11,3)4/h7,11H,1-6H3/t11-,16-/m0/s1
InChIKey QGVGIOJRXMISBH-ZBEGNZNMSA-N
Molecular Weight 292.331 g/mol
SMILES [C@@]12(C(=C(C)[C@@](C(=C2)OC(=O)C)(C(C1=O)(C)C)[H])C(=O)OC)C
SPLASH splash10-00di-9420000000-a901ae1ca93c128d7af9
Source of Spectrum D1-1999-227-9
Synonyms 7-(Methoxycarbonyl)-1-acetoxy-3,3,5-trimethylbicyclo[2.2.2]octa-1(6),7-dien-4-one Methyl 5-(acetyloxy)-1,3,8,8-tetramethyl-7-oxobicyclo[2.2.2]octa-2,5-diene-2-carboxylate
Wiley ID 835294