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2-(4-Bromobenzoyl)-1-phenyl-N-(3-nitrophenyl)ethanamine
SpectraBase Compound ID iXgui7oH16
InChI InChI=1S/C21H17BrN2O3/c22-17-11-9-16(10-12-17)21(25)14-20(15-5-2-1-3-6-15)23-18-7-4-8-19(13-18)24(26)27/h1-13,20,23H,14H2
InChIKey KZGFWXDLNBOITH-UHFFFAOYSA-N
Mol Weight 425.28 g/mol
Molecular Formula C21H17BrN2O3
Exact Mass 424.042255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42AsjBy78r8
Name 2-(4-Bromobenzoyl)-1-phenyl-N-(3-nitrophenyl)ethanamine
Alternate Name(s) 1-(4-bromophenyl)-3-(3-nitroanilino)-3-phenyl-1-propanone
Comments Less than 3 mono-isotopic peaks
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Formula C21H17BrN2O3
InChI InChI=1S/C21H17BrN2O3/c22-17-11-9-16(10-12-17)21(25)14-20(15-5-2-1-3-6-15)23-18-7-4-8-19(13-18)24(26)27/h1-13,20,23H,14H2
InChIKey KZGFWXDLNBOITH-UHFFFAOYSA-N
Molecular Weight 425.282 g/mol
SMILES N(C(CC(c1ccc(cc1)Br)=O)c1ccccc1)c1cc(ccc1)N(=O)=O
SPLASH splash10-004i-0090700000-f2db3747b79f5ddae5c3
Source of Spectrum SO-0-718-4
Wiley ID 1542428