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

View entire compound with spectra: 1 MS (GC)

2-[4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione
SpectraBase Compound ID H0lC45Ibinq
InChI InChI=1S/C26H26N2O5/c1-26(2)14-19(27-18-10-5-6-11-20(18)29)23(22(31)15-26)21(30)12-7-13-28-24(32)16-8-3-4-9-17(16)25(28)33/h3-6,8-11,27,29H,7,12-15H2,1-2H3
InChIKey RKXQDQAEMQODGU-UHFFFAOYSA-N
Mol Weight 446.5 g/mol
Molecular Formula C26H26N2O5
Exact Mass 446.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30ROnPiFf6U
Name 2-[4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26N2O5
InChI InChI=1S/C26H26N2O5/c1-26(2)14-19(27-18-10-5-6-11-20(18)29)23(22(31)15-26)21(30)12-7-13-28-24(32)16-8-3-4-9-17(16)25(28)33/h3-6,8-11,27,29H,7,12-15H2,1-2H3
InChIKey RKXQDQAEMQODGU-UHFFFAOYSA-N
Molecular Weight 446.503 g/mol
SMILES N(C1=C(C(CCCN2C(c3ccccc3C2=O)=O)=O)C(CC(C)(C)C1)=O)c1c(cccc1)O
SPLASH splash10-02ar-7950000000-16394661a9833e14e2e8
Synonyms 2-[4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butyl]isoindoline-1,3-dione 2-[4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutyl]isoindole-1,3-dione 2-[4-[2-(2-hydroxyanilino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]-4-keto-butyl]isoindoline-1,3-quinone 2-[4-[2-[(2-hydroxyphenyl)amino]-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione
Wiley ID 1512270