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N-(2-Nitro-4,6-dimethylphenyl)-2-(4-chlorophenoxy)acetamide
SpectraBase Compound ID 5jIbeSEpjag
InChI InChI=1S/C16H15ClN2O4/c1-10-7-11(2)16(14(8-10)19(21)22)18-15(20)9-23-13-5-3-12(17)4-6-13/h3-8H,9H2,1-2H3,(H,18,20)
InChIKey CBKZZKHUJFVABI-UHFFFAOYSA-N
Mol Weight 334.76 g/mol
Molecular Formula C16H15ClN2O4
Exact Mass 334.072035 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IJNkqMFHAxE
Name N-(2-Nitro-4,6-dimethylphenyl)-2-(4-chlorophenoxy)acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.072034667 u
Formula C16H15ClN2O4
InChI InChI=1S/C16H15ClN2O4/c1-10-7-11(2)16(14(8-10)19(21)22)18-15(20)9-23-13-5-3-12(17)4-6-13/h3-8H,9H2,1-2H3,(H,18,20)
InChIKey CBKZZKHUJFVABI-UHFFFAOYSA-N
Molecular Weight 334.759 g/mol
SMILES N(C(COc1ccc(cc1)Cl)=O)c1c(cc(cc1C)C)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943981