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(+-)-9-Benzyl-5,7-dichloro-8-methyl-2-phenyl-3,4,9,9a-tetrahydro-1H-pyrrolo[3,4-g]isoquinoline-1,3(2H)-dione

View entire compound with spectra: 1 MS (GC)

(+-)-9-Benzyl-5,7-dichloro-8-methyl-2-phenyl-3,4,9,9a-tetrahydro-1H-pyrrolo[3,4-g]isoquinoline-1,3(2H)-dione
SpectraBase Compound ID 7BGTofSMXGL
InChI InChI=1S/C25H20Cl2N2O2/c1-14-20-17(12-15-8-4-2-5-9-15)21-19(13-18(20)23(27)28-22(14)26)24(30)29(25(21)31)16-10-6-3-7-11-16/h2-11,17,19,21H,12-13H2,1H3
InChIKey JAKVYRFDVUVXEE-UHFFFAOYSA-N
Mol Weight 451.35 g/mol
Molecular Formula C25H20Cl2N2O2
Exact Mass 450.090183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C5vVgZPmoOC
Name (+-)-9-Benzyl-5,7-dichloro-8-methyl-2-phenyl-3,4,9,9a-tetrahydro-1H-pyrrolo[3,4-g]isoquinoline-1,3(2H)-dione
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Formula C25H20Cl2N2O2
InChI InChI=1S/C25H20Cl2N2O2/c1-14-20-17(12-15-8-4-2-5-9-15)21-19(13-18(20)23(27)28-22(14)26)24(30)29(25(21)31)16-10-6-3-7-11-16/h2-11,17,19,21H,12-13H2,1H3
InChIKey JAKVYRFDVUVXEE-UHFFFAOYSA-N
Molecular Weight 451.353 g/mol
SMILES c1(nc(c(c2C(C3C(Cc12)C(N(C3=O)c1ccccc1)=O)Cc1ccccc1)C)Cl)Cl
SPLASH splash10-0f6x-9100700000-df6cc30adc7b730b8751
Source of Spectrum KC-57-4210-18
Synonyms 9-Benzyl-5,7-dichloro-8-methyl-2-phenyl-3a,4,9,9a-tetrahydro-1H-pyrrolo[3,4-g]isoquinoline-1,3(2H)-dione
Wiley ID 1624092