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4-allyl-1-((4,8-dimethylnona-3,7-dien-1-yl)oxy)-2-methoxybenzene
SpectraBase Compound ID 8GxPZOLoKjp
InChI InChI=1S/C21H30O2/c1-6-9-19-13-14-20(21(16-19)22-5)23-15-8-12-18(4)11-7-10-17(2)3/h6,10,12-14,16H,1,7-9,11,15H2,2-5H3
InChIKey BHNQQUIIZLRFCB-UHFFFAOYSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRGeI9A2VkR
Name 4-allyl-1-((4,8-dimethylnona-3,7-dien-1-yl)oxy)-2-methoxybenzene
Appearance Colorless liquid
Carrier Gas Helium
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Formula C21H30O2
GC Oven Program Oven temp 250oC
InChI InChI=1S/C21H30O2/c1-6-9-19-13-14-20(21(16-19)22-5)23-15-8-12-18(4)11-7-10-17(2)3/h6,10,12-14,16H,1,7-9,11,15H2,2-5H3
InChIKey BHNQQUIIZLRFCB-UHFFFAOYSA-N
Inlet Type Splitless
Instrument Name GCMS
Ionization Type EI
Molecular Weight 314.469 g/mol
Quality 116
SMILES C(CC1=CC(=C(C=C1)OCCC=C(CCC=C(C)C)C)OC)=C
SPLASH splash10-03xr-6900000000-c84208a40ed3b37e3716
Sample Comments E/Z mixture
Source of Spectrum WO2023067040A1
Wiley ID 1897207