4-Amino-3-nitrobenzonitrile
Compound with spectra: 4 NMR, 3 FTIR, and 1 Raman
| SpectraBase Compound ID | CiYIbO4Mr8B |
|---|---|
| InChI | InChI=1S/C7H5N3O2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2 |
| InChIKey | JAHADAZIDZMHOP-UHFFFAOYSA-N |
| Mol Weight | 163.14 g/mol |
| Molecular Formula | C7H5N3O2 |
| Exact Mass | 163.038176 g/mol |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Alfa Aesar, Thermo Fisher Scientific |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Catalog Number | B23463 |
| Copyright | Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Alfa Aesar |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Catalog Number | B23463 |
| Technique | KBr1 |
| Copyright | Copyright © 2016-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Alfa Aesar, Thermo Fisher Scientific |
| Source of Spectrum | Bio-Rad Laboratories, Inc. |
| Catalog Number | B23463 |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Catalog Number | 324698 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3:CD3OD |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 324698 |
| Solvent | CDCl3 & DMSO-d6 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 324698 |
| Solvent | CDCl3 & DMSO-d6 |
- 4-Cyano-2-nitroaniline
- p-Amino-m-nitrobenzonitrile
- 3-Nitro-4-aminobenzonitrile
4-Fluoranyl-3-nitro-benzenecarbonitrile
N4-METHYL-2-NITRO-p-PHENYLENEDIAMINE
5-Nitro-o-tolunitrile
3-Fluoro-5-nitrobenzonitrile
4-Amino-2-nitrobenzonitrile
3-Chloro-5-nitrobenzonitrile
4-Bromo-2-nitro-1-nitroso-benzene
3-chloro-4-nitrobenzonitrile
3-Methyl-4-nitrobenzonitrile
4-Nitro-2-ethynylaniline
| Title | Journal or Book | Year |
|---|---|---|
| DNA Binding Compounds. V. Synthesis and Characterization of Boron Containing Bibenzimidazoles Related to the DNA Minor Groove Binder, Hoechst-33258 | Australian Journal of Chemistry | 1994 |
| Resonance and solvent effects on absorption spectra. 6. Substituent solvation effects on nitrogen-15 chemical shifts of para-substituted anilines and para-substituted 2-nitroanilines | The Journal of Organic Chemistry | 1987 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.
KnowItAll IR, Raman, and UV-Vis Spectral Libraries
Author: Wiley
The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.
KnowItAll Mass Spectral Library
Author: Wiley
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