Verapamil
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU226003
Dataset description:
This MassBank record with Accession MSBNK-Athens_Univ-AU226003 contains the MS2 mass spectrum of Verapamil with the InChIkey SGTNSNPWRIOYBX-UHFFFAOYSA-N.
Source: Verapamil
Chemical Info
| InChI | InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3 |
|---|---|
| SMILES | COC1=CC=C(CCN(C)CCCC(C#N)(C(C)C)C2=CC(OC)=C(OC)C=C2)C=C1OC |
| InChI Key | SGTNSNPWRIOYBX-UHFFFAOYSA-N |
| Molecular Formula | C27H38N2O4 |
| Exact Mass | 454.283 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 | 9b2be80e-064d-4e0a-b59f-eb9facff02c5 |
| Package id | msbnk-athens_univ-au226003 |
| Resource type | HTML |
| State | active |