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N,N-dimethyl-2,5-dinitro-p-phenylenediamine

View entire compound with spectra: 1 NMR, 1 FTIR, 1 Raman, and 1 UV-Vis

N,N-dimethyl-2,5-dinitro-p-phenylenediamine
SpectraBase Compound ID Jiwfasfnivb
InChI InChI=1S/C8H10N4O4/c1-10(2)7-4-6(11(13)14)5(9)3-8(7)12(15)16/h3-4H,9H2,1-2H3
InChIKey MRRUJAKGBGUUIF-UHFFFAOYSA-N
Mol Weight 226.19 g/mol
Molecular Formula C8H10N4O4
Exact Mass 226.070205 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KyVPKmlpFnV
Name N,N-Dimethyl-2,5-dinitro-p-phenylenediamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.070204814 u
Formula C8H10N4O4
InChI InChI=1S/C8H10N4O4/c1-10(2)7-4-6(11(13)14)5(9)3-8(7)12(15)16/h3-4H,9H2,1-2H3
InChIKey MRRUJAKGBGUUIF-UHFFFAOYSA-N
Molecular Weight 226.192 g/mol
SMILES NC=1C=C(C(=CC1N(=O)=O)N(C)C)N(=O)=O
Spectrum/Structure Validation Score (Raman) 0.990346