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2-(5-Methyl-6-oxooct-1-en-3-yl)propanedioic acid dimethyl ester
SpectraBase Compound ID ACWcEBrSlqj
InChI InChI=1S/C14H22O5/c1-6-10(8-9(3)11(15)7-2)12(13(16)18-4)14(17)19-5/h6,9-10,12H,1,7-8H2,2-5H3
InChIKey RSFKKMVWZZTNLG-UHFFFAOYSA-N
Mol Weight 270.32 g/mol
Molecular Formula C14H22O5
Exact Mass 270.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SlkFRGpqVk
Name 2-(5-Methyl-6-oxooct-1-en-3-yl)propanedioic acid dimethyl ester
Alternate Name(s) 2-[1-(3-keto-2-methyl-pentyl)allyl]malonic acid dimethyl ester Dimethyl 2-(3-methyl-4-oxo-1-vinyl-hexyl)propanedioate Dimethyl 2-(5-methyl-6-oxidanylidene-oct-1-en-3-yl)propanedioate Dimethyl 2-(5-methyl-6-oxooct-1-en-3-yl)propanedioate
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Formula C14H22O5
InChI InChI=1S/C14H22O5/c1-6-10(8-9(3)11(15)7-2)12(13(16)18-4)14(17)19-5/h6,9-10,12H,1,7-8H2,2-5H3
InChIKey RSFKKMVWZZTNLG-UHFFFAOYSA-N
Molecular Weight 270.325 g/mol
SMILES C(C(CC(C(=O)CC)C)C=C)(C(=O)OC)C(=O)OC
SPLASH splash10-0a5i-9600000000-e8ca5a49cf999339aee0
Source of Spectrum J-60-4957-5
Wiley ID 1274036