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BICYCLO[2.2.2]OCTANE-1,4-DICARBOXYLIC ACID, DIMETHYL ESTER
SpectraBase Compound ID caPN9f0CfM
InChI InChI=1S/C12H18O4/c1-15-9(13)11-3-6-12(7-4-11,8-5-11)10(14)16-2/h3-8H2,1-2H3
InChIKey HDOVTVDGSLEUSK-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NTjYopY4fL
Name Dimethyl bicyclo[2.2.2]octane-1,4-dicarboxylate
Alternate Name(s) bicyclo[2.2.2]octane-1,4-dicarboxylic acid dimethyl ester
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Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-15-9(13)11-3-6-12(7-4-11,8-5-11)10(14)16-2/h3-8H2,1-2H3
InChIKey HDOVTVDGSLEUSK-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES C12(C(=O)OC)CCC(CC2)(C(=O)OC)CC1
SPLASH splash10-0a4i-0900000000-88739f1b4b309845bab4
Source of Spectrum SO-0-74-4
Wiley ID 873080