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3-(4-Chloro-benzylamino)-1-(4-iodo-phenyl)-pyrrolidine-2,5-dione
SpectraBase Compound ID AA2F0au3F1X
InChI InChI=1S/C17H14ClIN2O2/c18-12-3-1-11(2-4-12)10-20-15-9-16(22)21(17(15)23)14-7-5-13(19)6-8-14/h1-8,15,20H,9-10H2
InChIKey DQBAFXDCKFSDKY-UHFFFAOYSA-N
Mol Weight 440.67 g/mol
Molecular Formula C17H14ClIN2O2
Exact Mass 439.97885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KhBtavkft8d
Name 3-(4-Chloro-benzylamino)-1-(4-iodo-phenyl)-pyrrolidine-2,5-dione
Alternate Name(s) 3-[(4-chlorobenzyl)amino]-1-(4-iodophenyl)pyrrolidine-2,5-quinone 3-[(4-chlorophenyl)methylamino]-1-(4-iodophenyl)pyrrolidine-2,5-dione
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Formula C17H14ClIN2O2
InChI InChI=1S/C17H14ClIN2O2/c18-12-3-1-11(2-4-12)10-20-15-9-16(22)21(17(15)23)14-7-5-13(19)6-8-14/h1-8,15,20H,9-10H2
InChIKey DQBAFXDCKFSDKY-UHFFFAOYSA-N
Molecular Weight 440.668 g/mol
SMILES N(C1C(N(c2ccc(I)cc2)C(C1)=O)=O)Cc1ccc(Cl)cc1
SPLASH splash10-0006-3900000000-89ceacf2e14e5953bee2
Wiley ID 1461626