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2-(3,7-diketo-4-methyl-2,4,5,6-tetrahydro-1H-inden-2-yl)acetic acid
SpectraBase Compound ID 9rdJrOX8SrM
InChI InChI=1S/C12H14O4/c1-6-2-3-9(13)8-4-7(5-10(14)15)12(16)11(6)8/h6-7H,2-5H2,1H3,(H,14,15)
InChIKey RSGZKMUIQLZGDD-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EnejW9lAOTs
Name 2-(3,7-diketo-4-methyl-2,4,5,6-tetrahydro-1H-inden-2-yl)acetic acid
Alternate Name(s) 2-(4-Methyl-3,7-dioxo-2,4,5,6-tetrahydro-1H-inden-2-yl)acetic acid 2-[4-methyl-3,7-bis(oxidanylidene)-2,4,5,6-tetrahydro-1H-inden-2-yl]ethanoic acid
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Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-6-2-3-9(13)8-4-7(5-10(14)15)12(16)11(6)8/h6-7H,2-5H2,1H3,(H,14,15)
InChIKey RSGZKMUIQLZGDD-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES OC(CC1CC2=C(C1=O)C(C)CCC2=O)=O
SPLASH splash10-0kl4-3930000000-bac565b571f1c7b664c0
Source of Spectrum F-50-2902-3
Wiley ID 1222325