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4-Bromo-N-(1-(2-fluorophenyl)but-3-enyl)aniline

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

4-Bromo-N-(1-(2-fluorophenyl)but-3-enyl)aniline
SpectraBase Compound ID 4xARG0Pi2zL
InChI InChI=1S/C16H15BrFN/c1-2-5-16(14-6-3-4-7-15(14)18)19-13-10-8-12(17)9-11-13/h2-4,6-11,16,19H,1,5H2
InChIKey TUXJZIDBHAREJL-UHFFFAOYSA-N
Mol Weight 320.21 g/mol
Molecular Formula C16H15BrFN
Exact Mass 319.037191 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FnVuirnmub4
Name 4-Bromo-N-(1-(2-fluorophenyl)but-3-enyl)aniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.037190650 u
Formula C16H15BrFN
InChI InChI=1S/C16H15BrFN/c1-2-5-16(14-6-3-4-7-15(14)18)19-13-10-8-12(17)9-11-13/h2-4,6-11,16,19H,1,5H2
InChIKey TUXJZIDBHAREJL-UHFFFAOYSA-N
Molecular Weight 320.205 g/mol
SMILES C=1C=C(C(=CC1)F)C(NC1=CC=C(C=C1)Br)CC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.876992