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2-(2-acetyl-1-methyl-hexylidene)malonic acid diethyl ester
SpectraBase Compound ID 7NZuoSPvpGd
InChI InChI=1S/C16H26O5/c1-6-9-10-13(12(5)17)11(4)14(15(18)20-7-2)16(19)21-8-3/h13H,6-10H2,1-5H3
InChIKey OEHXVICVWHAENU-UHFFFAOYSA-N
Mol Weight 298.38 g/mol
Molecular Formula C16H26O5
Exact Mass 298.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FnM6t1rEJEl
Name 2-(2-acetyl-1-methyl-hexylidene)malonic acid diethyl ester
Alternate Name(s) 2-(3-acetylheptan-2-ylidene)propanedioic acid diethyl ester diethyl 2-(2-acetyl-1-methyl-hexylidene)propanedioate diethyl 2-(3-acetylheptan-2-ylidene)propanedioate diethyl 2-(3-ethanoylheptan-2-ylidene)propanedioate
Comments Less than 3 mono-isotopic peaks
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Formula C16H26O5
InChI InChI=1S/C16H26O5/c1-6-9-10-13(12(5)17)11(4)14(15(18)20-7-2)16(19)21-8-3/h13H,6-10H2,1-5H3
InChIKey OEHXVICVWHAENU-UHFFFAOYSA-N
Molecular Weight 298.379 g/mol
SMILES C(C(=C(C(C(C)=O)CCCC)C)C(=O)OCC)(=O)OCC
SPLASH splash10-001i-0900000000-c5e5702c8065f35f07a5
Source of Spectrum F-68-9002-4
Wiley ID 1573688