Nalbuphine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001515
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA001515 contains the MS mass spectrum of Nalbuphine with the InChIkey NETZHAKZCGBWSS-CEDHKZHLSA-N.
Source: Nalbuphine
Chemical Info
| InChI | InChI=1S/C21H27NO4/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12/h4-5,12,15-16,19,23-25H,1-3,6-11H2/t15-,16+,19-,20-,21+/m0/s1 |
|---|---|
| SMILES | C(C1)CC1CN(C6)C(C4)C(O)(C5)C(C6)(C(C(O)C5)2)c(c34)c(c(O)cc3)O2 |
| InChI Key | NETZHAKZCGBWSS-CEDHKZHLSA-N |
| Molecular Formula | C21H27NO4 |
| Exact Mass | 357.194 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 | 5efd7c33-e8d2-4c9c-a3f7-ef397a4dc2fd |
| Package id | msbnk-waters-wa001515 |
| Resource type | HTML |
| State | active |