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(4E)-2-acetyl-5,9-dimethyl-deca-4,8-dienoic acid methyl ester
SpectraBase Compound ID EiEh70jWoB7
InChI InChI=1S/C15H24O3/c1-11(2)7-6-8-12(3)9-10-14(13(4)16)15(17)18-5/h7,9,14H,6,8,10H2,1-5H3/b12-9+
InChIKey BSTPZJQNOMFGJU-FMIVXFBMSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FI7tNiTWxnI
Name (4E)-2-acetyl-5,9-dimethyl-deca-4,8-dienoic acid methyl ester
Alternate Name(s) methyl (4E)-2-acetyl-5,9-dimethyl-deca-4,8-dienoate methyl (4E)-2-ethanoyl-5,9-dimethyl-deca-4,8-dienoate (4E)-2-acetyl-5,9-dimethyldeca-4,8-dienoic acid methyl ester
CAS Registry Number 51933-45-0
Comments Less than 3 mono-isotopic peaks
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Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-11(2)7-6-8-12(3)9-10-14(13(4)16)15(17)18-5/h7,9,14H,6,8,10H2,1-5H3/b12-9+
InChIKey BSTPZJQNOMFGJU-FMIVXFBMSA-N
Molecular Weight 252.354 g/mol
SMILES C(C(=O)OC)(C\C=C\(CCC=C(C)C)C)C(=O)C
SPLASH splash10-014i-9000000000-6706db597714d8bfcdf3
Source of Spectrum SK-29-3680-12
Wiley ID 880814