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3,4-Dinitrobenzonitrile

View entire compound with spectra: 4 NMR, 3 FTIR, and 1 Raman

3,4-Dinitrobenzonitrile
SpectraBase Compound ID C4ovkW5auH8
InChI InChI=1S/C7H3N3O4/c8-4-5-1-2-6(9(11)12)7(3-5)10(13)14/h1-3H
InChIKey QXFXDEHCVXHEBX-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 JRzxwzb2Usn
Name 3,4-Dinitrobenzonitrile
Catalog Number 316172
Classification Aromatic nitriles & cumulated double bonds
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3N3O4
InChI InChI=1S/C7H3N3O4/c8-4-5-1-2-6(9(11)12)7(3-5)10(13)14/h1-3H
InChIKey QXFXDEHCVXHEBX-UHFFFAOYSA-N
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Mull
Wiley ID SIAL_FTIR_1_6563