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2-[4-keto-4-[6-keto-4,4-dimethyl-2-(o-anisidino)cyclohexen-1-yl]butyl]isoindoline-1,3-quinone
SpectraBase Compound ID 51oprLz3upV
InChI InChI=1S/C27H28N2O5/c1-27(2)15-20(28-19-11-6-7-13-23(19)34-3)24(22(31)16-27)21(30)12-8-14-29-25(32)17-9-4-5-10-18(17)26(29)33/h4-7,9-11,13,28H,8,12,14-16H2,1-3H3
InChIKey YDVQDCXMJVMOSZ-UHFFFAOYSA-N
Mol Weight 460.53 g/mol
Molecular Formula C27H28N2O5
Exact Mass 460.199822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xRnRylNxnv
Name 2-[4-keto-4-[6-keto-4,4-dimethyl-2-(o-anisidino)cyclohexen-1-yl]butyl]isoindoline-1,3-quinone
Alternate Name(s) 2-[4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione 2-[4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butyl]isoindoline-1,3-dione 2-[4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutyl]isoindole-1,3-dione 2-[4-[2-[(2-methoxyphenyl)amino]-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione
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Formula C27H28N2O5
InChI InChI=1S/C27H28N2O5/c1-27(2)15-20(28-19-11-6-7-13-23(19)34-3)24(22(31)16-27)21(30)12-8-14-29-25(32)17-9-4-5-10-18(17)26(29)33/h4-7,9-11,13,28H,8,12,14-16H2,1-3H3
InChIKey YDVQDCXMJVMOSZ-UHFFFAOYSA-N
Molecular Weight 460.530 g/mol
SMILES N(C1=C(C(CCCN2C(c3ccccc3C2=O)=O)=O)C(CC(C)(C)C1)=O)c1c(OC)cccc1
SPLASH splash10-0uxr-3932000000-ba021544bc27307dfc83
Wiley ID 1512271