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N-(2-fluoranyl-4-nitro-phenyl)ethanamide

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

N-(2-fluoranyl-4-nitro-phenyl)ethanamide
SpectraBase Compound ID FDxh7Et6xAw
InChI InChI=1S/C8H7FN2O3/c1-5(12)10-8-3-2-6(11(13)14)4-7(8)9/h2-4H,1H3,(H,10,12)
InChIKey KFSFGCHQQCRZBB-UHFFFAOYSA-N
Mol Weight 198.15 g/mol
Molecular Formula C8H7FN2O3
Exact Mass 198.04407 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EkBrX0J9AE8
Name N-(2-Fluoranyl-4-nitro-phenyl)ethanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.044070253 u
Formula C8H7FN2O3
InChI InChI=1S/C8H7FN2O3/c1-5(12)10-8-3-2-6(11(13)14)4-7(8)9/h2-4H,1H3,(H,10,12)
InChIKey KFSFGCHQQCRZBB-UHFFFAOYSA-N
Molecular Weight 198.153 g/mol
SMILES C=1(N(=O)=O)C=C(F)C(NC(=O)C)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.986889