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4-ketoheptane-1,2,6,7-tetracarboxylic acid tetraethyl ester
SpectraBase Compound ID 4aleBF8TE4d
InChI InChI=1S/C19H30O9/c1-5-25-16(21)11-13(18(23)27-7-3)9-15(20)10-14(19(24)28-8-4)12-17(22)26-6-2/h13-14H,5-12H2,1-4H3
InChIKey NAOCVORPYYIWFS-UHFFFAOYSA-N
Mol Weight 402.44 g/mol
Molecular Formula C19H30O9
Exact Mass 402.188983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KYdgRsLV1v
Name 4-ketoheptane-1,2,6,7-tetracarboxylic acid tetraethyl ester
Alternate Name(s) 4-Oxoheptane-1,2,6,7-tetracarboxylic acid tetraethyl ester Tetraethyl 4-oxidanylideneheptane-1,2,6,7-tetracarboxylate Tetraethyl 4-oxoheptane-1,2,6,7-tetracarboxylate
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Formula C19H30O9
InChI InChI=1S/C19H30O9/c1-5-25-16(21)11-13(18(23)27-7-3)9-15(20)10-14(19(24)28-8-4)12-17(22)26-6-2/h13-14H,5-12H2,1-4H3
InChIKey NAOCVORPYYIWFS-UHFFFAOYSA-N
Molecular Weight 402.440 g/mol
SMILES C(C(CC(=O)OCC)CC(CC(C(=O)OCC)CC(=O)OCC)=O)(=O)OCC
SPLASH splash10-00ko-4950000000-f5051f1449d05092e02d
Source of Spectrum J-59-2603-16
Wiley ID 1370235