N-Desmethylclomipramine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000990
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA000990 contains the MS mass spectrum of N-Desmethylclomipramine with the InChIkey VPIXQGUBUKFLRF-UHFFFAOYSA-N.
Source: N-Desmethylclomipramine
Chemical Info
| InChI | InChI=1S/C18H21ClN2/c1-20-11-4-12-21-17-6-3-2-5-14(17)7-8-15-9-10-16(19)13-18(15)21/h2-3,5-6,9-10,13,20H,4,7-8,11-12H2,1H3 |
|---|---|
| SMILES | CNCCCN(c21)c(c3)c(ccc(Cl)3)CCc(cccc2)1 |
| InChI Key | VPIXQGUBUKFLRF-UHFFFAOYSA-N |
| Molecular Formula | C18H21ClN2 |
| Exact Mass | 300.139 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 | d1853d13-b8a4-4f5f-863c-81e343506535 |
| Package id | msbnk-waters-wa000990 |
| Resource type | HTML |
| State | active |