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4-(4-Methoxyphenyl)-2,5-dihydro-1-naphthoxepine
SpectraBase Compound ID DrVWmAg5e0v
InChI InChI=1S/C21H18O2/c1-22-19-10-8-15(9-11-19)17-12-13-23-21-18(14-17)7-6-16-4-2-3-5-20(16)21/h2-12H,13-14H2,1H3
InChIKey MJFGTFYBOIBSBG-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C21H18O2
Exact Mass 302.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JZa1GHXPGhC
Name 4-(4-Methoxyphenyl)-2,5-dihydro-1-naphthoxepine
Appearance Colorless liquid
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Formula C21H18O2
InChI InChI=1S/C21H18O2/c1-22-19-10-8-15(9-11-19)17-12-13-23-21-18(14-17)7-6-16-4-2-3-5-20(16)21/h2-12H,13-14H2,1H3
InChIKey MJFGTFYBOIBSBG-UHFFFAOYSA-N
Instrument Name Hewlett Packard series II
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.c22
Reported Formula C21H18O2
SMILES c12c(c3c(cc2)CC(=CCO3)c2ccc(cc2)OC)cccc1
SPLASH splash10-000i-0093000000-3dfb64b2d87fa74c7336
Source of Spectrum ARK-2008-213-7c
Thin-Layer Chromatography Rf =0.72 (ethyl acetate/n-hexane, 1:7)
Wiley ID 1869047