Efavirenz
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000368
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA000368 contains the MS mass spectrum of Efavirenz with the InChIkey XPOQHMRABVBWPR-ZDUSSCGKSA-N.
Source: Efavirenz
Chemical Info
| InChI | InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1 |
|---|---|
| SMILES | Clc(c3)cc(c(c3)1)C(C#CC(C2)C2)(OC(=O)N1)C(F)(F)F |
| InChI Key | XPOQHMRABVBWPR-ZDUSSCGKSA-N |
| Molecular Formula | C14H9ClF3NO2 |
| Exact Mass | 315.027 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 | 65021188-1d52-4374-bcc9-86b6c14d0e0c |
| Package id | msbnk-waters-wa000368 |
| Resource type | HTML |
| State | active |