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(4'aS,5'R,8'aS)-5'-hydroxy-4',8'-diketo-spiro[1,3-dioxolane-2,1'-2,3,5,8a-tetrahydronaphthalene]-4'a-carboxylic acid methyl ester
SpectraBase Compound ID CRedXENmljq
InChI InChI=1S/C14H16O7/c1-19-12(18)14-9(16)3-2-8(15)11(14)13(5-4-10(14)17)20-6-7-21-13/h2-3,9,11,16H,4-7H2,1H3/t9-,11+,14+/m1/s1
InChIKey JRPLKDZNXKLGJE-PUYPPJJSSA-N
Mol Weight 296.27 g/mol
Molecular Formula C14H16O7
Exact Mass 296.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pEwo8GDgb4
Name (4'aS,5'R,8'aS)-5'-hydroxy-4',8'-diketo-spiro[1,3-dioxolane-2,1'-2,3,5,8a-tetrahydronaphthalene]-4'a-carboxylic acid methyl ester
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Formula C14H16O7
InChI InChI=1S/C14H16O7/c1-19-12(18)14-9(16)3-2-8(15)11(14)13(5-4-10(14)17)20-6-7-21-13/h2-3,9,11,16H,4-7H2,1H3/t9-,11+,14+/m1/s1
InChIKey JRPLKDZNXKLGJE-PUYPPJJSSA-N
Molecular Weight 296.275 g/mol
SMILES O[C@]1([C@]2([C@](C3(OCCO3)CCC2=O)(C(=O)C=C1)[H])C(=O)OC)[H]
SPLASH splash10-014r-0090000000-e85d3ed236eb29b7fadf
Source of Spectrum HE-1999-242-6
Synonyms (4'aS,5'R,8'aS)-5'-hydroxy-4',8'-dioxo-4'a-spiro[1,3-dioxolane-2,1'-2,3,5,8a-tetrahydronaphthalene]carboxylic acid methyl ester Methyl (4'aS,5'R,8'aS)-5'-hydroxy-4',8'-dioxo-spiro[1,3-dioxolane-2,1'-2,3,5,8a-tetrahydronaphthalene]-4'a-carboxylate Methyl (4'aS,5'R,8'aS)-5'-oxidanyl-4',8'-bis(oxidanylidene)spiro[1,3-dioxolane-2,1'-2,3,5,8a-tetrahydronaphthalene]-4'a-carboxylate
Wiley ID 1613419