2-Nitro-5-thiocyanatobenzoic acid
Compound with spectra: 4 NMR, and 3 FTIR
| SpectraBase Compound ID | 6DQHmPUKpic |
|---|---|
| InChI | InChI=1S/C8H4N2O4S/c9-4-15-5-1-2-7(10(13)14)6(3-5)8(11)12/h1-3H,(H,11,12) |
| InChIKey | NQUNIMFHIWQQGJ-UHFFFAOYSA-N |
| Mol Weight | 224.19 g/mol |
| Molecular Formula | C8H4N2O4S |
| Exact Mass | 223.989178 g/mol |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Fluka AG, Buchs, Switzerland |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |
| 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 | 284866 |
| Solvent | CDCl3 & DMSO-d6 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Polysol |
| 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 | 284866 |
| Solvent | CDCl3 & DMSO-d6 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
| Catalog Number | N 516 |
| Technique | KBr WAFER |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 284866 |
| Technique | Mull |
| 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 | 284866 |
- BENZOIC ACID, 2-NITRO-5-THIO- CYANATO-,
- 2-Nitro-5-thiocyanobenzoic acid, NTCB
5-(Dimethylamino)-2-nitrobenzoic acid
5,5'-Dithiobis(2-nitrobenzoic acid)
Ethanone, 1-[5-(dimethylamino)-2-nitrophenyl]-
1,1,1,3,3,3-Hexafluoropropan-2-yl 2-nitrobenzoate
THIOCYANIC ACID, 4-ACETAMIDO-3-ACETYLPHENYL ESTER
Benzoic acid, 2-chloro-6-nitro-, methyl ester
2-Nitro-3-thiocyanato-benzoic acid
Benzoic acid, 3-chloro-2-nitro-, methyl ester
1,3-Benzenedicarboxylic acid, 2-nitro-, dimethyl ester
N-(4-morpholinyl)-2-nitrobenzamide
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
The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.