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2-[4-[(4aS,9bR)-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione
SpectraBase Compound ID 6BgAdCyRMBw
InChI InChI=1S/C25H27N3O3/c1-16-9-10-21-19(14-16)20-15-26(2)13-11-22(20)28(21)23(29)8-5-12-27-24(30)17-6-3-4-7-18(17)25(27)31/h3-4,6-7,9-10,14,20,22H,5,8,11-13,15H2,1-2H3/t20-,22-/m0/s1
InChIKey RREUSGFRPUFNEL-UNMCSNQZSA-N
Mol Weight 417.51 g/mol
Molecular Formula C25H27N3O3
Exact Mass 417.205242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGY83LioIKf
Name 2-[4-[(4aS,9bR)-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione
Alternate Name(s) 2-[4-[(4aS,9bR)-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl]-4-oxo-butyl]isoindoline-1,3-dione 2-[4-[(4aS,9bR)-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl]-4-oxobutyl]isoindole-1,3-dione 2-[4-[(4aS,9bR)-2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrid[4,3-b]indol-5-yl]-4-keto-butyl]isoindoline-1,3-quinone
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Formula C25H27N3O3
InChI InChI=1S/C25H27N3O3/c1-16-9-10-21-19(14-16)20-15-26(2)13-11-22(20)28(21)23(29)8-5-12-27-24(30)17-6-3-4-7-18(17)25(27)31/h3-4,6-7,9-10,14,20,22H,5,8,11-13,15H2,1-2H3/t20-,22-/m0/s1
InChIKey RREUSGFRPUFNEL-UNMCSNQZSA-N
Molecular Weight 417.509 g/mol
SMILES c1cc2C(N(C(c2cc1)=O)CCCC(N1[C@@]2([C@](CN(CC2)C)([H])c2c1ccc(C)c2)[H])=O)=O
SPLASH splash10-0a4i-9510000000-2fc6fa3bdf664c67cf20
Wiley ID 1457832