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2-(2-ethenylidenepentyl)propanedioic acid dimethyl ester
SpectraBase Compound ID C0Xrx3KDk5u
InChI InChI=1S/C12H18O4/c1-5-7-9(6-2)8-10(11(13)15-3)12(14)16-4/h10H,2,5,7-8H2,1,3-4H3
InChIKey LBOFQTLCOXCLNW-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 FjADQ72KjVD
Name 2-(2-ethenylidenepentyl)propanedioic acid dimethyl ester
Alternate Name(s) 2-(2-propylbuta-2,3-dienyl)malonic acid dimethyl ester dimethyl 2-(2-ethenylidenepentyl)propanedioate dimethyl 2-(2-vinylidenepentyl)propanedioate
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-5-7-9(6-2)8-10(11(13)15-3)12(14)16-4/h10H,2,5,7-8H2,1,3-4H3
InChIKey LBOFQTLCOXCLNW-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES C(C(=O)OC)(C(=O)OC)CC(=C=C)CCC
SPLASH splash10-004i-9010000000-981e0c158bf5218d79fb
Source of Spectrum J-67-2842-1
Wiley ID 1569628