| SpectraBase Spectrum ID |
8ItWq2tUYLY |
| Name |
Moclobemide |
| CAS Registry Number |
71320-77-9 |
| Classification |
Pharmaceutical drug, sympathomimetic, antidepressant |
| Comments |
Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
268.097855493 u |
| Formula |
C13H17ClN2O2 |
| InChI |
InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17) |
| InChIKey |
YHXISWVBGDMDLQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
268.744 g/mol |
| Nominal Mass |
268 u |
| Quality |
902 |
| Retention Index |
2092 |
| SMILES |
C(C1=CC=C(C=C1)Cl)(NCCN1CCOCC1)=O |
| SPLASH |
splash10-0udi-2900000000-1d9348d5c96cb5b9579a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzamide,4-chloro-N-(2-morpholin-4-ylethyl)
4-Chloro-N-(2-morpholin-4-ylethyl)benzamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006297 |
