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3,5-Dinitrobenzonitrile

View entire compound with spectra: 5 NMR, 4 FTIR, 1 Raman, 1 UV-Vis, and 1 MS (GC)

3,5-Dinitrobenzonitrile
SpectraBase Compound ID 9Lg9sfFTJYk
InChI InChI=1S/C7H3N3O4/c8-4-5-1-6(9(11)12)3-7(2-5)10(13)14/h1-3H
InChIKey SSDNULNTQAUNFQ-UHFFFAOYSA-N
Mol Weight 193.12 g/mol
Molecular Formula C7H3N3O4
Exact Mass 193.012356 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4P7xtPB5BYq
Name 3,5-Dinitrobenzonitrile
Source of Sample Aldrich
Catalog Number D195006
CAS Registry Number 4110-35-4
Classification Aromatic nitriles & cumulated double bonds
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3N3O4
InChI InChI=1S/C7H3N3O4/c8-4-5-1-6(9(11)12)3-7(2-5)10(13)14/h1-3H
InChIKey SSDNULNTQAUNFQ-UHFFFAOYSA-N
Purity 97%
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Mull
Wiley ID SIAL_FTIR_1_9554