Allopurinol
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00457
Dataset description:
This MassBank record with Accession MSBNK-Fiocruz-FIO00457 contains the MS2 mass spectrum of Allopurinol with the InChIkey OFCNXPDARWKPPY-UHFFFAOYSA-N.
Source: Allopurinol
Chemical Info
| InChI | InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10) |
|---|---|
| SMILES | C1=NNC2=C1C(=O)NC=N2 |
| InChI Key | OFCNXPDARWKPPY-UHFFFAOYSA-N |
| Molecular Formula | C5H4N4O |
| Exact Mass | 136.039 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | 86eb6de1-8fa1-49f6-9dca-a95083fec1e5 |
| Package id | msbnk-fiocruz-fio00457 |
| Resource type | HTML |
| State | active |