Pyrimethamine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01074803
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ01074803 contains the MS2 mass spectrum of Pyrimethamine with the InChIkey WKSAUQYGYAYLPV-UHFFFAOYSA-N.
Source: Pyrimethamine
Chemical Info
| InChI | InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17) |
|---|---|
| SMILES | CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1 |
| InChI Key | WKSAUQYGYAYLPV-UHFFFAOYSA-N |
| Molecular Formula | C12H13ClN4 |
| Exact Mass | 248.083 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 9, 2025 |
| Metadata last updated | February 9, 2025 |
| Created | February 9, 2025 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 78a738c4-a76e-43d2-96c8-76dc3f238b85 |
| Package id | msbnk-eawag-eq01074803 |
| Resource type | HTML |
| State | active |