Allopurinol
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00458
Dataset description:
This MassBank record with Accession MSBNK-Fiocruz-FIO00458 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) |
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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 |
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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 | a9400c0e-66fd-4038-8002-3fee54f90f31 |
Package id | msbnk-fiocruz-fio00458 |
Resource type | HTML |
State | active |