Quinine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-LCSB-LU027004
Dataset description:
This MassBank record with Accession MSBNK-LCSB-LU027004 contains the MS2 mass spectrum of Quinine with the InChIkey LOUPRKONTZGTKE-WZBLMQSHSA-N.
Chemical Info
| InChI | InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1 |
|---|---|
| SMILES | C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@H](O)c1ccnc2ccc(OC)cc12 |
| InChI Key | LOUPRKONTZGTKE-WZBLMQSHSA-N |
| Exact Mass | 324.184 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 | 85743a5f-2190-4abb-9893-7ffb40356c75 |
| Package id | msbnk-lcsb-lu027004 |
| Resource type | HTML |
| State | active |