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Ethyl (E)-2-acetyl-5,8,9-trimethyldeca-4,8-dienoate
SpectraBase Compound ID 3ghI7HsVldh
InChI InChI=1S/C17H28O3/c1-7-20-17(19)16(15(6)18)11-9-13(4)8-10-14(5)12(2)3/h9,16H,7-8,10-11H2,1-6H3/b13-9+
InChIKey PGNMBQKUIWCHGL-UKTHLTGXSA-N
Mol Weight 280.41 g/mol
Molecular Formula C17H28O3
Exact Mass 280.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HazCsY7quMy
Name Ethyl (E)-2-acetyl-5,8,9-trimethyldeca-4,8-dienoate
Appearance Colorless oil
Carrier Gas Helium (1.2 ml/min)
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Exact Mass 280.203844759 u
Formula C17H28O3
GC Column HP5-MS UI (30 m x 0.25 mm, film thickness 0.50 micrometer)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C17H28O3/c1-7-20-17(19)16(15(6)18)11-9-13(4)8-10-14(5)12(2)3/h9,16H,7-8,10-11H2,1-6H3/b13-9+
InChIKey PGNMBQKUIWCHGL-UKTHLTGXSA-N
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/chem.202100962
Quality 385
Reported Formula C17H28O3
SMILES C(C)OC(C(C\C=C\(CCC(=C(C)C)C)C)C(C)=O)=O
SPLASH splash10-0a59-4910000000-bff6ab7ab85ec43c9c34
Source of Spectrum QE-27-SM4-S11 (DOI: 10.1002/chem.202100962)
Thin-Layer Chromatography 0.40 (cyclohexane/ethyl acetate, 10:1)
Wiley ID 1904023