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(R,Z)-2,5,5-trimethyl-2-(4,8,12-trimethyltridec-3-en-1-yl)-1,3-dioxane
SpectraBase Compound ID BQ9KUgpEiwb
InChI InChI=1S/C23H44O2/c1-19(2)11-8-12-20(3)13-9-14-21(4)15-10-16-23(7)24-17-22(5,6)18-25-23/h15,19-20H,8-14,16-18H2,1-7H3/b21-15-/t20-/m1/s1
InChIKey HALGESSBEJXZMN-YLCCHKQJSA-N
Mol Weight 352.6 g/mol
Molecular Formula C23H44O2
Exact Mass 352.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTdP28YK6uO
Name (R,Z)-2,5,5-trimethyl-2-(4,8,12-trimethyltridec-3-en-1-yl)-1,3-dioxane
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Formula C23H44O2
InChI InChI=1S/C23H44O2/c1-19(2)11-8-12-20(3)13-9-14-21(4)15-10-16-23(7)24-17-22(5,6)18-25-23/h15,19-20H,8-14,16-18H2,1-7H3/b21-15-/t20-/m1/s1
InChIKey HALGESSBEJXZMN-YLCCHKQJSA-N
Ionization Type EI
Molecular Weight 352.603 g/mol
SMILES CC1(COC(CC\C=C\(C)CCC[C@@](CCCC(C)C)(C)[H])(C)OC1)C
SPLASH splash10-004i-5901000000-972cb4956754ac128019
Sample Comments E/Z = 4:96
Source of Spectrum WO2014096065A1
Wiley ID 1850029