| SpectraBase Spectrum ID |
8GRydW9Xuee |
| Name |
Domperidone |
| CAS Registry Number |
57808-66-9 |
| Classification |
Pharmaceutical drug, antiemetic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
425.161852731 u |
| Formula |
C22H24ClN5O2 |
| InChI |
InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30) |
| InChIKey |
FGXWKSZFVQUSTL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
425.920 g/mol |
| Nominal Mass |
425 u |
| Quality |
999 |
| Retention Index |
3554 |
| SMILES |
C=12N(C(NC2=CC(=CC1)Cl)=O)C1CCN(CC1)CCCN1C=2C(NC1=O)=CC=CC2 |
| SPLASH |
splash10-03xr-4590000000-3c18d2bcdb879240fa34 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-Chloro-1-(1-[3-(2,3-dihydro-2-oxobenzimidazol-1-yl)propyl]-4-piperidyl)-2(3H)-benzimidazolone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013993 |
