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N,N-dimethyl-2,6-dinitro-p-phenylenediamine
SpectraBase Compound ID CGSiVvJ2tUI
InChI InChI=1S/C8H10N4O4/c1-10(2)8-6(11(13)14)3-5(9)4-7(8)12(15)16/h3-4H,9H2,1-2H3
InChIKey QBSPJPAGKUPZOJ-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 HiR71srsj88
Name N,N-Dimethyl-2,6-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)8-6(11(13)14)3-5(9)4-7(8)12(15)16/h3-4H,9H2,1-2H3
InChIKey QBSPJPAGKUPZOJ-UHFFFAOYSA-N
Molecular Weight 226.192 g/mol
SMILES NC=1C=C(C(=C(C1)N(=O)=O)N(C)C)N(=O)=O
Spectrum/Structure Validation Score (Raman) 0.992015