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1,2,3-trimethoxy-5-(3-phenylprop-1-enyl)benzene
SpectraBase Compound ID 9ecqqn5KdpH
InChI InChI=1S/C18H20O3/c1-19-16-12-15(13-17(20-2)18(16)21-3)11-7-10-14-8-5-4-6-9-14/h4-9,11-13H,10H2,1-3H3
InChIKey VKNKKWXALSHKLR-UHFFFAOYSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LnRzitX5wTK
Name 1,2,3-trimethoxy-5-(3-phenylprop-1-enyl)benzene
Appearance Pale-yellow solid
Carrier Gas Hydrogen (1.2 bar) (30 ml/min)
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Exact Mass 284.141244501 u
Formula C18H20O3
GC Column Optima-1-MS (30 m x 0.25 mm)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C18H20O3/c1-19-16-12-15(13-17(20-2)18(16)21-3)11-7-10-14-8-5-4-6-9-14/h4-9,11-13H,10H2,1-3H3
InChIKey VKNKKWXALSHKLR-UHFFFAOYSA-N
Instrument Name Agilent HP 6980 GC-5937N MSD
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202300050
Quality 82
SMILES C1(=CC(=C(C(=C1)OC)OC)OC)C=CCC1=CC=CC=C1
SPLASH splash10-001i-0190000000-da9ca172b4f897c52299
Source of Spectrum K1-26-SM23-7i (DOI: 10.1002/ejoc.202300050)
Thin-Layer Chromatography 0.45 (cHex/EtOAc, 3:1)
Wiley ID 1910450