Warfarin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF404204
Dataset description:
This MassBank record with Accession MSBNK-UFZ-UF404204 contains the MS2 mass spectrum of Warfarin with the InChIkey PJVWKTKQMONHTI-UHFFFAOYSA-N.
Source: Warfarin
Chemical Info
| InChI | InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3 |
|---|---|
| SMILES | CC(=O)CC(C1=CC=CC=C1)C1=C(O)C2=CC=CC=C2OC1=O |
| InChI Key | PJVWKTKQMONHTI-UHFFFAOYSA-N |
| Molecular Formula | C19H16O4 |
| Exact Mass | 308.105 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 | 95d8cdea-c36e-430f-9218-7049dc3020fd |
| Package id | msbnk-ufz-uf404204 |
| Resource type | HTML |
| State | active |