Acenocoumarol
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001214
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA001214 contains the MS mass spectrum of Acenocoumarol with the InChIkey VABCILAOYCMVPS-HNNXBMFYSA-N.
Source: Acenocoumarol
Chemical Info
| InChI | InChI=1S/C19H15NO6/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23/h2-9,15,22H,10H2,1H3/t15-/m0/s1 |
|---|---|
| SMILES | CC(=O)CC(c(c3)ccc(N(=O)=O)c3)C(C(=O)1)=C(O)c(c2)c(ccc2)O1 |
| InChI Key | VABCILAOYCMVPS-HNNXBMFYSA-N |
| Molecular Formula | C19H15NO6 |
| Exact Mass | 353.090 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 | 3a2fe7d3-bd8c-4b3e-a818-088ff08cc042 |
| Package id | msbnk-waters-wa001214 |
| Resource type | HTML |
| State | active |