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N-(2-Bromophenyl)-3-(trifluoromethyl)aniline

View entire compound with spectra: 1 NMR, and 1 FTIR

N-(2-Bromophenyl)-3-(trifluoromethyl)aniline
SpectraBase Compound ID 3iNbNhT4QaC
InChI InChI=1S/C13H9BrF3N/c14-11-6-1-2-7-12(11)18-10-5-3-4-9(8-10)13(15,16)17/h1-8,18H
InChIKey UJBIBLAIZTVPPQ-UHFFFAOYSA-N
Mol Weight 316.12 g/mol
Molecular Formula C13H9BrF3N
Exact Mass 314.987047 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B76ajuoa4aJ
Name N-(2-Bromophenyl)-3-(trifluoromethyl)aniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.987046783 u
Formula C13H9BrF3N
InChI InChI=1S/C13H9BrF3N/c14-11-6-1-2-7-12(11)18-10-5-3-4-9(8-10)13(15,16)17/h1-8,18H
InChIKey UJBIBLAIZTVPPQ-UHFFFAOYSA-N
Molecular Weight 316.121 g/mol
SMILES C(F)(F)(F)C1=CC(=CC=C1)NC1=CC=CC=C1Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947076