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4-nitro-N-[2-[(4-nitrobenzoyl)amino]phenyl]benzamide
SpectraBase Compound ID BaoPNoxp3aC
InChI InChI=1S/C20H14N4O6/c25-19(13-5-9-15(10-6-13)23(27)28)21-17-3-1-2-4-18(17)22-20(26)14-7-11-16(12-8-14)24(29)30/h1-12H,(H,21,25)(H,22,26)
InChIKey XLLSAFDUMYKCBU-UHFFFAOYSA-N
Mol Weight 406.35 g/mol
Molecular Formula C20H14N4O6
Exact Mass 406.091334 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Dk22q2UHSl6
Name 4-Nitro-N-[2-[(4-nitrobenzoyl)amino]phenyl]benzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.091334181 u
Formula C20H14N4O6
InChI InChI=1S/C20H14N4O6/c25-19(13-5-9-15(10-6-13)23(27)28)21-17-3-1-2-4-18(17)22-20(26)14-7-11-16(12-8-14)24(29)30/h1-12H,(H,21,25)(H,22,26)
InChIKey XLLSAFDUMYKCBU-UHFFFAOYSA-N
Molecular Weight 406.354 g/mol
SMILES C=1(N(=O)=O)C=CC(C(NC2=C(NC(C3=CC=C(N(=O)=O)C=C3)=O)C=CC=C2)=O)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938247