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(E)-2-(2,6-dimethylhepta-1,5-dien-1-yl)-5,5-dimethyl-1,3-dioxane
SpectraBase Compound ID 7vheLPRKKTG
InChI InChI=1S/C15H26O2/c1-12(2)7-6-8-13(3)9-14-16-10-15(4,5)11-17-14/h7,9,14H,6,8,10-11H2,1-5H3/b13-9+
InChIKey SWMSVAUOTBOQRU-UKTHLTGXSA-N
Mol Weight 238.37 g/mol
Molecular Formula C15H26O2
Exact Mass 238.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ie5FFEoKlGa
Name (E)-2-(2,6-Dimethylhepta-1,5-dien-1-yl)-5,5-dimethyl-1,3-dioxane
Appearance Colorless oil
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Exact Mass 238.193280075 u
Formula C15H26O2
InChI InChI=1S/C15H26O2/c1-12(2)7-6-8-13(3)9-14-16-10-15(4,5)11-17-14/h7,9,14H,6,8,10-11H2,1-5H3/b13-9+
InChIKey SWMSVAUOTBOQRU-UKTHLTGXSA-N
Instrument Name HP 5890 GC-5989B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.202300820
Molecular Weight 238.371 g/mol
Quality 170
SMILES CC(=CCC\C(=C\C1OCC(CO1)(C)C)C)C
SPLASH splash10-014i-9200000000-dd771c9ae385554d9485
Sample Comments E Isomer, E/Z = 1:0.6
Source of Spectrum QE-29-SM22-(E)-2ak (DOI: 10.1002/chem.202300820)
Thin-Layer Chromatography 0.30 (PE/Et2O, 98:2)
Wiley ID 1910264