MDMA (Ecstasy)
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001054
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA001054 contains the MS mass spectrum of MDMA (Ecstasy) with the InChIkey SHXWCVYOXRDMCX-UHFFFAOYSA-N.
Source: MDMA (Ecstasy)
Chemical Info
| InChI | InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3 |
|---|---|
| SMILES | CNC(C)Cc(c1)cc(O2)c(OC2)c1 |
| InChI Key | SHXWCVYOXRDMCX-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110 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 | ac7a2673-fff1-4eb7-ba76-a564573efb03 |
| Package id | msbnk-waters-wa001054 |
| Resource type | HTML |
| State | active |