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N-(2,4-Difluorophenyl)-3-oxobutanamide

View entire compound with spectra: 1 NMR, and 1 FTIR

N-(2,4-Difluorophenyl)-3-oxobutanamide
SpectraBase Compound ID 9a1xprTAjlq
InChI InChI=1S/C10H9F2NO2/c1-6(14)4-10(15)13-9-3-2-7(11)5-8(9)12/h2-3,5H,4H2,1H3,(H,13,15)
InChIKey CNAPKPKZXWZLMD-UHFFFAOYSA-N
Mol Weight 213.18 g/mol
Molecular Formula C10H9F2NO2
Exact Mass 213.060135 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IjHPX1rGQAo
Name N-(2,4-Difluorophenyl)-3-oxobutanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.060134858 u
Formula C10H9F2NO2
InChI InChI=1S/C10H9F2NO2/c1-6(14)4-10(15)13-9-3-2-7(11)5-8(9)12/h2-3,5H,4H2,1H3,(H,13,15)
InChIKey CNAPKPKZXWZLMD-UHFFFAOYSA-N
Molecular Weight 213.184 g/mol
SMILES C1(F)=C(C=CC(=C1)F)NC(=O)CC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.806594