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7-(4-Methoxyphenyl)-4,7-dioxoheptanoic acid
SpectraBase Compound ID B6ZnjFiIqNZ
InChI InChI=1S/C14H16O5/c1-19-12-6-2-10(3-7-12)13(16)8-4-11(15)5-9-14(17)18/h2-3,6-7H,4-5,8-9H2,1H3,(H,17,18)
InChIKey URIXTVZXAZEZKR-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C14H16O5
Exact Mass 264.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fSEXG4qFML
Name 7-(4-Methoxyphenyl)-4,7-dioxoheptanoic acid
Alternate Name(s) 4,7-Diketo-7-(4-methoxyphenyl)enanthic acid 7-(4-Methoxyphenyl)-4,7-bis(oxidanylidene)heptanoic acid Heptanoic acid, 7-(4-methoxyphenyl)-4,7-dioxo-
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Formula C14H16O5
InChI InChI=1S/C14H16O5/c1-19-12-6-2-10(3-7-12)13(16)8-4-11(15)5-9-14(17)18/h2-3,6-7H,4-5,8-9H2,1H3,(H,17,18)
InChIKey URIXTVZXAZEZKR-UHFFFAOYSA-N
Molecular Weight 264.277 g/mol
SMILES OC(CCC(=O)CCC(c1ccc(OC)cc1)=O)=O
SPLASH splash10-000i-3900000000-79899cb9409783997925
Wiley ID 1439797