Codeine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML82462
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML82462 contains the MS mass spectrum of Codeine with the InChIkey OROGSEYTTFOCAN-DNJOTXNNSA-N.
Source: Codeine
Chemical Info
| InChI | InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O |
| InChI Key | OROGSEYTTFOCAN-DNJOTXNNSA-N |
| Molecular Formula | C18H21NO3 |
| Exact Mass | 299.152 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | a294eff4-a19d-4f7c-9c5b-76b7a42c88f2 |
| Package id | msbnk-washington_state_univ-bml82462 |
| Resource type | HTML |
| State | active |