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2-[2'-(2"-Bromo-4"-chlorophenyl)ethyl]-4-chlorophenylamine
SpectraBase Compound ID xeh70dFbtL
InChI InChI=1S/C14H12BrCl2N/c15-13-8-12(17)4-3-9(13)1-2-10-7-11(16)5-6-14(10)18/h3-8H,1-2,18H2
InChIKey VAMRCARMKCSNDR-UHFFFAOYSA-N
Mol Weight 345.07 g/mol
Molecular Formula C14H12BrCl2N
Exact Mass 342.953018 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9AtQfOdKxoX
Name 2-[2'-(2""""-Bromo-4""""-chlorophenyl)ethyl]-4-chlorophenylamine
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 342.953017790 u
Formula C14H12BrCl2N
InChI InChI=1S/C14H12BrCl2N/c15-13-8-12(17)4-3-9(13)1-2-10-7-11(16)5-6-14(10)18/h3-8H,1-2,18H2
InChIKey VAMRCARMKCSNDR-UHFFFAOYSA-N
Molecular Weight 345.067 g/mol
SMILES C1(=CC(Cl)=CC=C1CCC=1C(=CC=C(C1)Cl)N)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.931291