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4-Acetamido-3-nitro-N,N-diphenylbenzamide
SpectraBase Compound ID 7q70KoZoFER
InChI InChI=1S/C21H17N3O4/c1-15(25)22-19-13-12-16(14-20(19)24(27)28)21(26)23(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14H,1H3,(H,22,25)
InChIKey RBDHNFVIUKNIJX-UHFFFAOYSA-N
Mol Weight 375.38 g/mol
Molecular Formula C21H17N3O4
Exact Mass 375.121906 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6PaJjYdmXDG
Name 4-Acetamido-3-nitro-N,N-diphenylbenzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 375.121906035 u
Formula C21H17N3O4
InChI InChI=1S/C21H17N3O4/c1-15(25)22-19-13-12-16(14-20(19)24(27)28)21(26)23(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14H,1H3,(H,22,25)
InChIKey RBDHNFVIUKNIJX-UHFFFAOYSA-N
Molecular Weight 375.384 g/mol
SMILES C1(=C(C=C(C=C1)C(N(C1=CC=CC=C1)C1=CC=CC=C1)=O)N(=O)=O)NC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.939212