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2-(2,6-Dimethylphenyl)-6-methoxy-4-(4-methoxyphenyl)-1H-benzo[f]isoindole-1,3(2H)-dione
SpectraBase Compound ID 3JAwT2zlu3F
InChI InChI=1S/C28H23NO4/c1-16-6-5-7-17(2)26(16)29-27(30)23-14-19-10-13-21(33-4)15-22(19)24(25(23)28(29)31)18-8-11-20(32-3)12-9-18/h5-15H,1-4H3
InChIKey QZDIKOPISXXCIA-UHFFFAOYSA-N
Mol Weight 437.5 g/mol
Molecular Formula C28H23NO4
Exact Mass 437.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8MsiZg0MS0V
Name 2-(2,6-Dimethylphenyl)-6-methoxy-4-(4-methoxyphenyl)-1H-benzo[f]isoindole-1,3(2H)-dione
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H23NO4
InChI InChI=1S/C28H23NO4/c1-16-6-5-7-17(2)26(16)29-27(30)23-14-19-10-13-21(33-4)15-22(19)24(25(23)28(29)31)18-8-11-20(32-3)12-9-18/h5-15H,1-4H3
InChIKey QZDIKOPISXXCIA-UHFFFAOYSA-N
Instrument Name Finnigan Trace DSQ-GC Ultra
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.231
Molecular Weight 437.495 g/mol
SMILES C1(N(C(c2c1c(c1c(c2)ccc(c1)OC)-c1ccc(cc1)OC)=O)c1c(cccc1C)C)=O
SPLASH splash10-000l-0105900000-34fdcc975f9d235b13d2
Source of Spectrum BJO-13-SM23-4s
Thin-Layer Chromatography Rf = 0.13 (n-hexane:EtOAc, 10:1)
Wiley ID 1848293