5-Nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
5-Nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid Structure
Systematic / IUPAC Name: 5-Nitro-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid
ID: Reference3968
Other Names:
1,2,3,6-Tetrahydro-5-nitro-2,6-dioxo-4-pyrimidinecarboxylic acid;
2,6-Dihydroxy-5-nitropyrimidine-4-carboxylic acid;
4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-5-nitro-2,6-dioxo-;
5-Nitro-2,6-dioxo-1,3-dihydropyrimidine-4-carboxylic acid;
5-Nitro-6-carboxyuracil
; more
Formula: C5H3N3O6
Spectral Data
5-Nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 117 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 2/26/2016 7:37:39 AM |
Identificators
| InChI | InChI=1S/C5H3N3O6/c9-3-2(8(13)14)1(4(10)11)6-5(12)7-3/h(H,10,11)(H2,6,7,9,12) |
| InChI Key | OPGJGRWULGFTOS-UHFFFAOYSA-N |
| Canonical SMILES | |
| CAS | 17687240 |
| Splash | |
| Other Names |
1,2,3,6-Tetrahydro-5-nitro-2,6-dioxo-4-pyrimidinecarboxylic acid; 2,6-Dihydroxy-5-nitropyrimidine-4-carboxylic acid; 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-5-nitro-2,6-dioxo-; 5-Nitro-2,6-dioxo-1,3-dihydropyrimidine-4-carboxylic acid; 5-Nitro-6-carboxyuracil; 5-Nitroorotic acid; Nitro-orotic acid |
In Other Databases
| PubChem | 103442 |
| ChemSpider | 93393 |
| ChemIDPlus | 065717137 |
| ChEMBL | CHEMBL1614935 |