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N(1)-(2,4-Dinitrophenyl)-4-methyl-m-phenylenediamine
SpectraBase Compound ID Dw3m2KIFqBn
InChI InChI=1S/C13H12N4O4/c1-8-2-3-9(6-11(8)14)15-12-5-4-10(16(18)19)7-13(12)17(20)21/h2-7,15H,14H2,1H3
InChIKey RBNOUDPBTDVYIC-UHFFFAOYSA-N
Mol Weight 288.26 g/mol
Molecular Formula C13H12N4O4
Exact Mass 288.085855 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LsKpDBKWboK
Name N(1)-(2,4-Dinitrophenyl)-4-methyl-m-phenylenediamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.085854878 u
Formula C13H12N4O4
InChI InChI=1S/C13H12N4O4/c1-8-2-3-9(6-11(8)14)15-12-5-4-10(16(18)19)7-13(12)17(20)21/h2-7,15H,14H2,1H3
InChIKey RBNOUDPBTDVYIC-UHFFFAOYSA-N
Molecular Weight 288.263 g/mol
SMILES C1(NC2=CC=C(C=C2N(=O)=O)N(=O)=O)=CC(=C(C=C1)C)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.969583