| SpectraBase Spectrum ID |
8K68yOxnXt2 |
| Name |
Thioridazine |
| CAS Registry Number |
50-52-2 |
| Classification |
Pharmaceutical drug, tranquiliser |
| Comments |
Spectrum verified by crosschecking against external libraries (two 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 |
370.153741193 u |
| Formula |
C21H26N2S2 |
| InChI |
InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3 |
| InChIKey |
KLBQZWRITKRQQV-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
370.573 g/mol |
| Nominal Mass |
370 u |
| Quality |
932 |
| Retention Index |
3114 |
| SMILES |
C1=2N(C=3C(SC2C=CC(=C1)SC)=CC=CC3)CCC1N(CCCC1)C |
| SPLASH |
splash10-0002-9321000000-fee704b7f3a48d7f08eb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
10-[2-(1-Methyl-2-piperidyl)ethyl]-2-methylsulfanyl-phenothiazine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009265 |
