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4-ketocyclohex-2-ene-1,1,3-tricarboxylic acid trimethyl ester
SpectraBase Compound ID xviDflVFmS
InChI InChI=1S/C12H14O7/c1-17-9(14)7-6-12(10(15)18-2,11(16)19-3)5-4-8(7)13/h6H,4-5H2,1-3H3
InChIKey PXLNEGXMUCOJET-UHFFFAOYSA-N
Mol Weight 270.24 g/mol
Molecular Formula C12H14O7
Exact Mass 270.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPPJjVMAMNm
Name 4-ketocyclohex-2-ene-1,1,3-tricarboxylic acid trimethyl ester
Alternate Name(s) 4-Oxocyclohex-2-ene-1,1,3-tricarboxylic acid trimethyl ester Trimethyl 4-oxidanylidenecyclohex-2-ene-1,1,3-tricarboxylate Trimethyl 4-oxocyclohex-2-ene-1,1,3-tricarboxylate
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Formula C12H14O7
InChI InChI=1S/C12H14O7/c1-17-9(14)7-6-12(10(15)18-2,11(16)19-3)5-4-8(7)13/h6H,4-5H2,1-3H3
InChIKey PXLNEGXMUCOJET-UHFFFAOYSA-N
Molecular Weight 270.237 g/mol
SMILES C1(C=C(C(=O)OC)C(CC1)=O)(C(=O)OC)C(=O)OC
SPLASH splash10-01tc-0490000000-fd699415fca43c938903
Source of Spectrum J-59-6714-9
Wiley ID 1273755