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(1R*,2R*,3R*,4R*,6S*)-6-Hydroxy-3,4,6-trimethyl-5,8-dioxobicyclo[2.2.2]octane-2-carbaldehyde
SpectraBase Compound ID EeRo7NU5hkW
InChI InChI=1S/C12H16O4/c1-6-7(5-13)8-4-9(14)11(6,2)10(15)12(8,3)16/h5-8,16H,4H2,1-3H3/t6-,7-,8+,11-,12+/m1/s1
InChIKey JYJLDDSCVCBCJV-GANOUAKVSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KT4WqY3nPca
Name (1R*,2R*,3R*,4R*,6S*)-6-Hydroxy-3,4,6-trimethyl-5,8-dioxobicyclo[2.2.2]octane-2-carbaldehyde
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Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-6-7(5-13)8-4-9(14)11(6,2)10(15)12(8,3)16/h5-8,16H,4H2,1-3H3/t6-,7-,8+,11-,12+/m1/s1
InChIKey JYJLDDSCVCBCJV-GANOUAKVSA-N
Literature Reference DOI 10.1021/ol702062p
Molecular Weight 224.256 g/mol
SMILES O[C@]1(C)C([C@]2(C(=O)C[C@]1([C@](C=O)([C@]2(C)[H])[H])[H])C)=O
SPLASH splash10-05ir-3900000000-33b7df5c294e925de927
Source of Spectrum A1-9-4563/SMS6-4
Synonyms (1R,2R,3R,4R,6S)-6-hydroxy-3,4,6-trimethyl-5,8-dioxobicyclo[2.2.2]octane-2-carbaldehyde
Wiley ID 1758720