| SpectraBase Spectrum ID |
K9xMCmrwCyd |
| Name |
Bupropion |
| CAS Registry Number |
34911-55-2 |
| Collision Energy |
5 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. 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 |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
239.746 g/mol |
| Nominal Mass |
239 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
240.115 |
| SMILES |
N(C(C)(C)C)C(C)C(=O)C1=CC(Cl)=CC=C1 |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_135.9 |
