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N-(4-Bromobenzyl)-3-fluoroaniline

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

N-(4-Bromobenzyl)-3-fluoroaniline
SpectraBase Compound ID DwfpoNcg2fe
InChI InChI=1S/C13H11BrFN/c14-11-6-4-10(5-7-11)9-16-13-3-1-2-12(15)8-13/h1-8,16H,9H2
InChIKey FFABUCHITMJHLS-UHFFFAOYSA-N
Mol Weight 280.14 g/mol
Molecular Formula C13H11BrFN
Exact Mass 279.005891 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H1UVNstC5bz
Name N-(4-Bromobenzyl)-3-fluoroaniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.005890521 u
Formula C13H11BrFN
InChI InChI=1S/C13H11BrFN/c14-11-6-4-10(5-7-11)9-16-13-3-1-2-12(15)8-13/h1-8,16H,9H2
InChIKey FFABUCHITMJHLS-UHFFFAOYSA-N
Molecular Weight 280.140 g/mol
SMILES C1(NCC=2C=CC(=CC2)Br)=CC(=CC=C1)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.868717