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N-(4-Fluorophenyl)-4-bromobenzylamine

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

N-(4-Fluorophenyl)-4-bromobenzylamine
SpectraBase Compound ID AxUhv4btbL0
InChI InChI=1S/C13H11BrFN/c14-11-3-1-10(2-4-11)9-16-13-7-5-12(15)6-8-13/h1-8,16H,9H2
InChIKey XNPKTLAZMJUIHZ-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 3MTFKldiK2f
Name N-(4-Fluorophenyl)-4-bromobenzylamine
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/c14-11-3-1-10(2-4-11)9-16-13-7-5-12(15)6-8-13/h1-8,16H,9H2
InChIKey XNPKTLAZMJUIHZ-UHFFFAOYSA-N
Molecular Weight 280.140 g/mol
SMILES C=1(NCC=2C=CC(=CC2)Br)C=CC(=CC1)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917799