6-Hydroxy-2-(methylsulfanyl)-4-pyrimidinecarboxylic acid
6-Hydroxy-2-(methylsulfanyl)-4-pyrimidinecarboxylic acid Structure
Systematic / IUPAC Name: 2-(Methylsulfanyl)-6-oxo-1,6-dihydro-4-pyrimidinecarboxylic acid
ID: Reference6093
Other Names:
2-(Methylsulfanyl)-6-oxo-3,6-dihydropyrimidine-4-carboxylic acid;
2-Methylsulfanyl-4-oxo-1H-pyrimidine-6-carboxylic acid;
6-Hydroxy-2-(methylsulfanyl)pyrimidine-4-carboxylic acid;
6-Hydroxy-2-(methylthio)-4-pyrimidinecarboxylic acid;
6-Hydroxy-2-(methylthio)pyrimidine-4-carboxylic acid
; more
Formula: C6H6N2O3S
Spectral Data
6-Hydroxy-2-(methylsulfanyl)-4-pyrimidinecarboxylic 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 | 119 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 11/25/2016 8:37:07 AM |
Identificators
| InChI | InChI=1S/C6H6N2O3S/c1-12-6-7-3(5(10)11)2-4(9)8-6/h2H,1H3,(H,10,11)(H,7,8,9) |
| InChI Key | DUBCMCDVRJTNQR-UHFFFAOYSA-N |
| Canonical SMILES | CSC1=NC(=O)C=C(N1)C(=O)O |
| CAS | 6314143 |
| Splash | |
| Other Names |
2-(Methylsulfanyl)-6-oxo-3,6-dihydropyrimidine-4-carboxylic acid; 2-Methylsulfanyl-4-oxo-1H-pyrimidine-6-carboxylic acid; 6-Hydroxy-2-(methylsulfanyl)pyrimidine-4-carboxylic acid; 6-Hydroxy-2-(methylthio)-4-pyrimidinecarboxylic acid; 6-Hydroxy-2-(methylthio)pyrimidine-4-carboxylic acid; 6-Hydroxy-2-methylthiopyrimidine-4-carboxylic acid; Hydroxymethylsulfanylpyrimidinecarboxylicacid |