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4-ketocyclohexane-1,1,3-tricarboxylic acid trimethyl ester
SpectraBase Compound ID KT6cjT8aBj9
InChI InChI=1S/C12H16O7/c1-17-9(14)7-6-12(10(15)18-2,11(16)19-3)5-4-8(7)13/h7H,4-6H2,1-3H3
InChIKey VNMXZSWOKNCHAM-UHFFFAOYSA-N
Mol Weight 272.25 g/mol
Molecular Formula C12H16O7
Exact Mass 272.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNHk7kIBXdi
Name 4-ketocyclohexane-1,1,3-tricarboxylic acid trimethyl ester
Alternate Name(s) Trimethyl 4-Oxocyclohexane-1,1,3-tricarboxylate 4-Oxocyclohexane-1,1,3-tricarboxylic acid trimethyl ester Trimethyl 4-oxidanylidenecyclohexane-1,1,3-tricarboxylate
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Formula C12H16O7
InChI InChI=1S/C12H16O7/c1-17-9(14)7-6-12(10(15)18-2,11(16)19-3)5-4-8(7)13/h7H,4-6H2,1-3H3
InChIKey VNMXZSWOKNCHAM-UHFFFAOYSA-N
Molecular Weight 272.253 g/mol
SMILES C1(CC(C(=O)OC)C(CC1)=O)(C(=O)OC)C(=O)OC
SPLASH splash10-006x-0690000000-f0f39fd33450c6550de6
Source of Spectrum QA-37-408-1
Wiley ID 861092