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2,3-Diketo-1,4-dipropyl-bicyclo[2.2.2]octa-5,7-diene-5-carboxylic acid methyl ester
SpectraBase Compound ID H4M1Ig3cHR7
InChI InChI=1S/C16H20O4/c1-4-6-15-8-9-16(7-5-2,13(18)12(15)17)11(10-15)14(19)20-3/h8-10H,4-7H2,1-3H3
InChIKey GPTJSWBYPAIFIB-UHFFFAOYSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvqOUTOfy7C
Name 2,3-Diketo-1,4-dipropyl-bicyclo[2.2.2]octa-5,7-diene-5-carboxylic acid methyl ester
Alternate Name(s) 2,3-Dioxo-1,4-dipropyl-5-bicyclo[2.2.2]octa-5,7-dienecarboxylic acid methyl ester Methyl 2,3-bis(oxidanylidene)-1,4-dipropyl-bicyclo[2.2.2]octa-5,7-diene-5-carboxylate Methyl 2,3-dioxo-1,4-dipropyl-bicyclo[2.2.2]octa-5,7-diene-5-carboxylate
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Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-4-6-15-8-9-16(7-5-2,13(18)12(15)17)11(10-15)14(19)20-3/h8-10H,4-7H2,1-3H3
InChIKey GPTJSWBYPAIFIB-UHFFFAOYSA-N
Molecular Weight 276.332 g/mol
SMILES C12(C(=CC(C=C2)(CCC)C(C1=O)=O)C(=O)OC)CCC
SPLASH splash10-00dr-0950000000-9c14b679a069fc5eae21
Source of Spectrum QA-30-75-6
Wiley ID 860862