| SpectraBase Spectrum ID |
Dk3tKgxy4zQ |
| Name |
Bupropion |
| CAS Registry Number |
34911-55-2 |
| Classification |
Pharmaceutical drug, sympathomimetic, antidepressant |
| Comments |
Spectrum verified by crosschecking against external libraries (one 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 |
239.107691903 u |
| Formula |
C13H18ClNO |
| InChI |
InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3 |
| InChIKey |
SNPPWIUOZRMYNY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
239.746 g/mol |
| Nominal Mass |
239 u |
| Quality |
995 |
| Retention Index |
1782 |
| SMILES |
C(NC(C)(C)C)(C(C1=CC(=CC=C1)Cl)=O)C |
| SPLASH |
splash10-0006-9300000000-0b43410963eefd13ca40 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Amfebutamon
Amfebutamone
Anfebutamona
Zyban
(R,S)-2-(tert-Butylamino)-3'-chloro-propiophenone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000374 |
