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2-(N-(2-bromo-4-methyl-phenyl)anilino)isoindoline-1,3-dione
SpectraBase Compound ID ZXup5lgAeO
InChI InChI=1S/C21H15BrN2O2/c1-14-11-12-19(18(22)13-14)23(15-7-3-2-4-8-15)24-20(25)16-9-5-6-10-17(16)21(24)26/h2-13H,1H3
InChIKey YQLLWOKSXRDGCH-UHFFFAOYSA-N
Mol Weight 407.27 g/mol
Molecular Formula C21H15BrN2O2
Exact Mass 406.031691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CG6u62GNAfD
Name 2-(N-(2-bromo-4-methyl-phenyl)anilino)isoindoline-1,3-dione
Alternate Name(s) 2-(N-(2-bromo-4-methyl-phenyl)anilino)isoindoline-1,3-quinone 2-(N-(2-bromo-4-methylphenyl)anilino)isoindole-1,3-dione 2-[(2-bromanyl-4-methyl-phenyl)-phenyl-amino]isoindole-1,3-dione
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Formula C21H15BrN2O2
InChI InChI=1S/C21H15BrN2O2/c1-14-11-12-19(18(22)13-14)23(15-7-3-2-4-8-15)24-20(25)16-9-5-6-10-17(16)21(24)26/h2-13H,1H3
InChIKey YQLLWOKSXRDGCH-UHFFFAOYSA-N
Molecular Weight 407.267 g/mol
SMILES C1(=O)c2c(C(=O)N1N(c1ccccc1)c1c(cc(cc1)C)Br)cccc2
SPLASH splash10-0a4i-0301900000-5a071c907b75c8af4923
Source of Spectrum J-66-8614-1
Wiley ID 1568738