| SpectraBase Spectrum ID |
8FqSvMO9UO0 |
| Name |
Metoclopramide AC |
| CAS Registry Number |
5608-13-9 |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
341.150619342 u |
| Formula |
C16H24ClN3O3 |
| InChI |
InChI=1S/C16H24ClN3O3/c1-5-20(6-2)8-7-18-16(22)12-9-13(17)14(19-11(3)21)10-15(12)23-4/h9-10H,5-8H2,1-4H3,(H,18,22)(H,19,21) |
| InChIKey |
CUDFIXBYMDJBQT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
341.839 g/mol |
| Nominal Mass |
341 u |
| Quality |
996 |
| Retention Index |
2585 |
| SMILES |
C=1(C(=CC(=C(C1)Cl)NC(=O)C)OC)C(NCCN(CC)CC)=O |
| SPLASH |
splash10-000i-9100000000-1d8b00f0f947d8199532 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-(acetylamino)-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_033426 |
