Scopolamine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002402
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA002402 contains the MS mass spectrum of Scopolamine with the InChIkey STECJAGHUSJQJN-FWXGHANASA-N.
Source: Scopolamine
Chemical Info
| InChI | InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11-,12-,13-,14+,15-,16+/m1/s1 |
|---|---|
| SMILES | OCC(c(c4)cccc4)C(=O)OC(C2)CC(N(C)3)C(O1)C1C23 |
| InChI Key | STECJAGHUSJQJN-FWXGHANASA-N |
| Molecular Formula | C17H21NO4 |
| Exact Mass | 303.147 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 | 8bf7e744-9480-4bf1-b5c2-70bae1f31555 |
| Package id | msbnk-waters-wa002402 |
| Resource type | HTML |
| State | active |