Pyrimidine
13983
Reference
Pyrimidine Structure
Systematic / IUPAC Name: Pyrimidine
ID: Reference13983
Other Names: AA-4605
Formula: C4H4N2
Class: Endogenous Metabolites
Spectral Data
Pyrimidine 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 | Orbitrap ID-X with ETD_Cal Gateshead |
| No. of Spectral Trees | 1 |
| No. of Spectra | 281 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/8/2026 9:05:20 AM |
Identificators
| InChI | InChI=1S/C4H4N2/c1-2-5-4-6-3-1/h1-4H |
| InChI Key | CZPWVGJYEJSRLH-UHFFFAOYSA-N |
| Canonical SMILES | c1cncnc1 |
| CAS | |
| Splash | |
| Other Names | AA-4605 |
In Other Databases
| PubChem | 9260; 9260 |
| KEGG | C00396 |
| Wikipedia | Pyrimidine |
| ChEMBL | CHEMBL15562 |
| ChEBI | CHEBI:16898 |
| ChemSpider | More details; 8903 |
| HMDb | HMDB0003361; HMDB03361 |