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2,6-Dichloro-n~4~-[(4-nitrophenyl)methylidene]-1,4-benzenediamine
SpectraBase Compound ID 5i9aXmkJqjy
InChI InChI=1S/C13H9Cl2N3O2/c14-11-5-9(6-12(15)13(11)16)17-7-8-1-3-10(4-2-8)18(19)20/h1-7H,16H2/b17-7+
InChIKey JXBXPZPTMDFZKW-REZTVBANSA-N
Mol Weight 310.14 g/mol
Molecular Formula C13H9Cl2N3O2
Exact Mass 309.007182 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EL0tcoZbeiq
Name 2,6-Dichloro-N~4~-[(4-nitrophenyl)methylidene]-1,4-benzenediamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.007181940 u
Formula C13H9Cl2N3O2
InChI InChI=1S/C13H9Cl2N3O2/c14-11-5-9(6-12(15)13(11)16)17-7-8-1-3-10(4-2-8)18(19)20/h1-7H,16H2/b17-7+
InChIKey JXBXPZPTMDFZKW-REZTVBANSA-N
Molecular Weight 310.140 g/mol
SMILES C=1C(\C=N\C=2C=C(Cl)C(=C(C2)Cl)N)=CC=C(N(=O)=O)C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.946619