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Octanedioic acid, 2,7-bis(methylene)-, dimethyl ester
SpectraBase Compound ID 7A8wy7ekl13
InChI InChI=1S/C12H18O4/c1-9(11(13)15-3)7-5-6-8-10(2)12(14)16-4/h1-2,5-8H2,3-4H3
InChIKey KKJUCNRRSNRICJ-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 4jiCIH2JhIR
Name Octanedioic acid, 2,7-bis(methylene)-, dimethyl ester
Alternate Name(s) Dimethyl 2,7-dimethyleneoctanedioate Dimethyl 2,7-dimethylideneoctanedioate 2,7-Dimethyleneoctanedioic acid dimethyl ester
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Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-9(11(13)15-3)7-5-6-8-10(2)12(14)16-4/h1-2,5-8H2,3-4H3
InChIKey KKJUCNRRSNRICJ-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES COC(=O)C(=C)CCCCC(=C)C(=O)OC
SPLASH splash10-066r-9800000000-27ae42941f84edfac140
Source of Spectrum JX-2015-0-695
Wiley ID 1720606