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1,3-Cyclohexanedicarboxylic acid, 4,6-dioxo-2-phenyl-, dimethyl ester
SpectraBase Compound ID 3pbKlPlznPR
InChI InChI=1S/C16H16O6/c1-21-15(19)13-10(17)8-11(18)14(16(20)22-2)12(13)9-6-4-3-5-7-9/h3-7,12-14H,8H2,1-2H3
InChIKey MBQWCIIUXPAJBZ-UHFFFAOYSA-N
Mol Weight 304.3 g/mol
Molecular Formula C16H16O6
Exact Mass 304.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdKbleHtAIh
Name 1,3-Cyclohexanedicarboxylic acid, 4,6-dioxo-2-phenyl-, dimethyl ester
Alternate Name(s) Dimethyl 4,6-dioxo-2-phenylcyclohexane-1,3-dicarboxylate 4,6-Dioxo-2-phenylcyclohexane-1,3-dicarboxylic acid dimethyl ester Dimethyl 4,6-dioxo-2-phenyl-cyclohexane-1,3-dicarboxylate Dimethyl 4,6-bis(oxidanylidene)-2-phenyl-cyclohexane-1,3-dicarboxylate
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Formula C16H16O6
InChI InChI=1S/C16H16O6/c1-21-15(19)13-10(17)8-11(18)14(16(20)22-2)12(13)9-6-4-3-5-7-9/h3-7,12-14H,8H2,1-2H3
InChIKey MBQWCIIUXPAJBZ-UHFFFAOYSA-N
Molecular Weight 304.298 g/mol
SMILES COC(=O)C1C(C(C(=O)CC1=O)C(=O)OC)c1ccccc1
SPLASH splash10-03di-2960000000-cc2722fcca85e25cd0cf
Source of Spectrum JX-2015-2-1752
Wiley ID 1723375