acetaminophen_BTP_M4
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000503
Dataset description:
This MassBank record with Accession MSBNK-UoB-XB000503 contains the MS2 mass spectrum of acetaminophen_BTP_M4 with the InChIkey IGTYILLPRJOVFY-UHFFFAOYSA-N.
Source: acetaminophen_BTP_M4
Chemical Info
| InChI | InChI=1S/C8H9NO5S/c1-6(10)9-7-2-4-8(5-3-7)14-15(11,12)13/h2-5H,1H3,(H,9,10)(H,11,12,13) |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)OS(=O)(=O)O |
| InChI Key | IGTYILLPRJOVFY-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO5S |
| Exact Mass | 231.020 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 4.0 International (CC BY 4.0) |
| Id | b7744676-972a-4447-aa4a-41d0f6f3c9b0 |
| Package id | msbnk-uob-xb000503 |
| Resource type | HTML |
| State | active |