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Methyl-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]amine

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

Methyl-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]amine
SpectraBase Compound ID GpQlV7pgZhm
InChI InChI=1S/C13H8F5N/c1-19-7-4-2-6(3-5-7)8-9(14)11(16)13(18)12(17)10(8)15/h2-5,19H,1H3
InChIKey BGBHCFBUWXHZBA-UHFFFAOYSA-N
Mol Weight 273.21 g/mol
Molecular Formula C13H8F5N
Exact Mass 273.05769 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8RKocT5P4oq
Name Methyl-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.057690077 u
Formula C13H8F5N
InChI InChI=1S/C13H8F5N/c1-19-7-4-2-6(3-5-7)8-9(14)11(16)13(18)12(17)10(8)15/h2-5,19H,1H3
InChIKey BGBHCFBUWXHZBA-UHFFFAOYSA-N
Molecular Weight 273.206 g/mol
SMILES C=1(C(=C(F)C(=C(C1F)F)F)F)C1=CC=C(C=C1)NC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.856553