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(E)-2-(4-Bromobenzoyl)-N-(tert-butyl)-4-(4-chlorobenzylidene)-1-(4-chlorophenyl)-5-oxopyrrolidine-2-carboxamide
SpectraBase Compound ID 82j4FiyufdV
InChI InChI=1S/C29H25BrCl2N2O3/c1-28(2,3)33-27(37)29(25(35)19-6-8-21(30)9-7-19)17-20(16-18-4-10-22(31)11-5-18)26(36)34(29)24-14-12-23(32)13-15-24/h4-16H,17H2,1-3H3,(H,33,37)/b20-16+
InChIKey SMBREUOVVHPXIR-CAPFRKAQSA-N
Mol Weight 600.34 g/mol
Molecular Formula C29H25BrCl2N2O3
Exact Mass 598.042561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXOgDVcunHE
Name (E)-2-(4-Bromobenzoyl)-N-(tert-butyl)-4-(4-chlorobenzylidene)-1-(4-chlorophenyl)-5-oxopyrrolidine-2-carboxamide
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Formula C29H25BrCl2N2O3
InChI InChI=1S/C29H25BrCl2N2O3/c1-28(2,3)33-27(37)29(25(35)19-6-8-21(30)9-7-19)17-20(16-18-4-10-22(31)11-5-18)26(36)34(29)24-14-12-23(32)13-15-24/h4-16H,17H2,1-3H3,(H,33,37)/b20-16+
InChIKey SMBREUOVVHPXIR-CAPFRKAQSA-N
Molecular Weight 600.340 g/mol
SMILES N(C(C1(N(C(=O)\C(C1)=C\c1ccc(cc1)Cl)c1ccc(cc1)Cl)C(c1ccc(cc1)Br)=O)=O)C(C)(C)C
SPLASH splash10-000i-3900210000-92a9b70ba9843cf45388
Source of Spectrum F-69-3827-6s
Wiley ID 1738228