2-[4-[2-(4-bromoanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione

SpectraBase Compound ID	C2PohKKkXYP
InChI	InChI=1S/C26H25BrN2O4/c1-26(2)14-20(28-17-11-9-16(27)10-12-17)23(22(31)15-26)21(30)8-5-13-29-24(32)18-6-3-4-7-19(18)25(29)33/h3-4,6-7,9-12,28H,5,8,13-15H2,1-2H3
InChIKey	NGYAZNUSMJKRLQ-UHFFFAOYSA-N Google Search
Mol Weight	509.4 g/mol
Molecular Formula	C26H25BrN2O4
Exact Mass	508.09977 g/mol

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SpectraBase Spectrum ID	K6atEmnN6rW
Name	2-[4-[2-(4-bromoanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione
Alternate Name(s)	2-[4-[2-(4-bromoanilino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butyl]isoindoline-1,3-dione 2-[4-[2-(4-bromoanilino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutyl]isoindole-1,3-dione 2-[4-[2-(4-bromoanilino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]-4-keto-butyl]isoindoline-1,3-quinone 2-[4-[2-[(4-bromophenyl)amino]-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H25BrN2O4
InChI	InChI=1S/C26H25BrN2O4/c1-26(2)14-20(28-17-11-9-16(27)10-12-17)23(22(31)15-26)21(30)8-5-13-29-24(32)18-6-3-4-7-19(18)25(29)33/h3-4,6-7,9-12,28H,5,8,13-15H2,1-2H3
InChIKey	NGYAZNUSMJKRLQ-UHFFFAOYSA-N
Molecular Weight	509.400 g/mol
SMILES	N(C1=C(C(CCCN2C(c3ccccc3C2=O)=O)=O)C(CC(C)(C)C1)=O)c1ccc(Br)cc1
SPLASH	splash10-0wpj-4915000000-9044f6ee297f94cb3470
Wiley ID	1512273