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4-(4-((5-methylocta-1,5-dien-4-yl)oxy)phenyl)butan-2-one
SpectraBase Compound ID 4g2npYcuy6k
InChI InChI=1S/C19H26O2/c1-5-7-15(3)19(8-6-2)21-18-13-11-17(12-14-18)10-9-16(4)20/h6-7,11-14,19H,2,5,8-10H2,1,3-4H3
InChIKey XRBJSZHYPVPVAY-UHFFFAOYSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H26O2
Exact Mass 286.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEE6LucvfSX
Name 4-(4-((5-methylocta-1,5-dien-4-yl)oxy)phenyl)butan-2-one
Appearance Colorless liquid
Carrier Gas Helium
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Exact Mass 286.193280075 u
Formula C19H26O2
GC Oven Program Oven temp 250oC
InChI InChI=1S/C19H26O2/c1-5-7-15(3)19(8-6-2)21-18-13-11-17(12-14-18)10-9-16(4)20/h6-7,11-14,19H,2,5,8-10H2,1,3-4H3
InChIKey XRBJSZHYPVPVAY-UHFFFAOYSA-N
Inlet Type Splitless
Instrument Name GCMS
Ionization Type EI
Molecular Weight 286.415 g/mol
Quality 113
SMILES CC(C(CC=C)OC1=CC=C(C=C1)CCC(C)=O)=CCC
SPLASH splash10-05al-9800000000-1eefdedac4d834a3c71d
Sample Comments Mixture of E/Z isomers
Source of Spectrum WO2023067040A1
Wiley ID 1897205