| SpectraBase Spectrum ID |
7h4EJ94blIS |
| Name |
Perphenazine |
| CAS Registry Number |
58-39-9 |
| Collision Energy |
30 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
403.148511342 u |
| Formula |
C21H26ClN3OS |
| InChI |
InChI=1S/C21H26ClN3OS/c22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h1-2,4-7,16,26H,3,8-15H2 |
| InChIKey |
RGCVKNLCSQQDEP-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
403.972 g/mol |
| Nominal Mass |
403 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
404.156 |
| SMILES |
OCCN1CCN(CC1)CCCN1C2=C(SC=3C1=CC=CC3)C=CC(Cl)=C2 |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethanol |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_718.5 |
