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4,4-Dimethylcyclopentan-3-one-1,2-dicarboxylic acid, diethyl ester
SpectraBase Compound ID Cr4A7S8sFi5
InChI InChI=1S/C13H20O5/c1-5-17-11(15)8-7-13(3,4)10(14)9(8)12(16)18-6-2/h8-9H,5-7H2,1-4H3
InChIKey XLMQNRLZMVYVHH-UHFFFAOYSA-N
Mol Weight 256.3 g/mol
Molecular Formula C13H20O5
Exact Mass 256.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99ytCVFhLax
Name 4,4-Dimethylcyclopentan-3-one-1,2-dicarboxylic acid, diethyl ester
Alternate Name(s) 3-keto-4,4-dimethyl-cyclopentane-1,2-dicarboxylic acid diethyl ester 4,4-Dimethyl-3-oxocyclopentane-1,2-dicarboxylic acid diethyl ester Diethyl 4,4-dimethyl-3-oxidanylidene-cyclopentane-1,2-dicarboxylate Diethyl 4,4-dimethyl-3-oxo-1,2-cyclopentanedicarboxylate Diethyl 4,4-dimethyl-3-oxo-cyclopentane-1,2-dicarboxylate
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Formula C13H20O5
InChI InChI=1S/C13H20O5/c1-5-17-11(15)8-7-13(3,4)10(14)9(8)12(16)18-6-2/h8-9H,5-7H2,1-4H3
InChIKey XLMQNRLZMVYVHH-UHFFFAOYSA-N
Molecular Weight 256.298 g/mol
SMILES C1C(C(C(C1(C)C)=O)C(=O)OCC)C(=O)OCC
SPLASH splash10-004i-9800000000-4df402e3d880bf8dc20b
Wiley ID 1478853