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N-(4-Methyl-2,6-dinitrophenyl)acetamide

View entire compound with spectra: 1 FTIR

N-(4-Methyl-2,6-dinitrophenyl)acetamide
SpectraBase Compound ID FjNnIaS17ib
InChI InChI=1S/C9H9N3O5/c1-5-3-7(11(14)15)9(10-6(2)13)8(4-5)12(16)17/h3-4H,1-2H3,(H,10,13)
InChIKey OFIDOLGSIHMBKD-UHFFFAOYSA-N
Mol Weight 239.19 g/mol
Molecular Formula C9H9N3O5
Exact Mass 239.05422 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A40pnTimdzL
Name N-(4-Methyl-2,6-dinitrophenyl)acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.054220397 u
Formula C9H9N3O5
InChI InChI=1S/C9H9N3O5/c1-5-3-7(11(14)15)9(10-6(2)13)8(4-5)12(16)17/h3-4H,1-2H3,(H,10,13)
InChIKey OFIDOLGSIHMBKD-UHFFFAOYSA-N
Molecular Weight 239.187 g/mol
SMILES C1(N(=O)=O)=C(C(=CC(=C1)C)N(=O)=O)NC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.981288