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Ethyl 2-acetyl-2,4,5-trimethyl-4-hexenoate
SpectraBase Compound ID H2abfzuCoby
InChI InChI=1S/C13H22O3/c1-7-16-12(15)13(6,11(5)14)8-10(4)9(2)3/h7-8H2,1-6H3
InChIKey RFFMJHZHNVNMBU-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlyEkVz7cyj
Name Ethyl 2-acetyl-2,4,5-trimethyl-4-hexenoate
Alternate Name(s) 2-Acetyl-2,4,5-trimethyl-4-hexenoic acid ethyl ester 2-Acetyl-2,4,5-trimethyl-hex-4-enoic acid ethyl ester 4-Hexenoic acid, 2-acetyl-2,4,5-trimethyl-, ethyl ester Ethyl 2-acetyl-2,4,5-trimethyl-hex-4-enoate Ethyl 2-ethanoyl-2,4,5-trimethyl-hex-4-enoate
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Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-7-16-12(15)13(6,11(5)14)8-10(4)9(2)3/h7-8H2,1-6H3
InChIKey RFFMJHZHNVNMBU-UHFFFAOYSA-N
Molecular Weight 226.316 g/mol
SMILES CC(CC(C(=O)C)(C)C(=O)OCC)=C(C)C
SPLASH splash10-052o-9400000000-c46fe74452a4663fcee6
Wiley ID 1495777