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2-[4-keto-4-[6-keto-4,4-dimethyl-2-(propylamino)cyclohexen-1-yl]butyl]isoindoline-1,3-quinone
SpectraBase Compound ID I9UNehYd4Uc
InChI InChI=1S/C23H28N2O4/c1-4-11-24-17-13-23(2,3)14-19(27)20(17)18(26)10-7-12-25-21(28)15-8-5-6-9-16(15)22(25)29/h5-6,8-9,24H,4,7,10-14H2,1-3H3
InChIKey XTKFDSMLQXGCAO-UHFFFAOYSA-N
Mol Weight 396.49 g/mol
Molecular Formula C23H28N2O4
Exact Mass 396.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcAdt1LBvyc
Name 2-[4-keto-4-[6-keto-4,4-dimethyl-2-(propylamino)cyclohexen-1-yl]butyl]isoindoline-1,3-quinone
Alternate Name(s) 2-[4-[4,4-dimethyl-6-oxidanylidene-2-(propylamino)cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione 2-[4-[4,4-dimethyl-6-oxo-2-(propylamino)-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione 2-[4-[4,4-dimethyl-6-oxo-2-(propylamino)cyclohexen-1-yl]-4-oxo-butyl]isoindoline-1,3-dione 2-[4-[4,4-dimethyl-6-oxo-2-(propylamino)cyclohexen-1-yl]-4-oxobutyl]isoindole-1,3-dione Isoindole-1,3-dione, 2-[4-(4,4-dimethyl-6-oxo-2-propylaminocyclohex-1-enyl)-4-oxobutyl]-
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Formula C23H28N2O4
InChI InChI=1S/C23H28N2O4/c1-4-11-24-17-13-23(2,3)14-19(27)20(17)18(26)10-7-12-25-21(28)15-8-5-6-9-16(15)22(25)29/h5-6,8-9,24H,4,7,10-14H2,1-3H3
InChIKey XTKFDSMLQXGCAO-UHFFFAOYSA-N
Molecular Weight 396.487 g/mol
SMILES N(C1=C(C(CCCN2C(c3ccccc3C2=O)=O)=O)C(CC(C)(C)C1)=O)CCC
SPLASH splash10-052u-9440000000-b2480b40f4d8893f49e8
Source of Spectrum AD-0-2532-0
Wiley ID 1436179