| SpectraBase Spectrum ID |
HFtRzKOtqK2 |
| Name |
Mesoridazine-M (Methylsulfoxid-phenothiazine) |
| Classification |
Pharmaceutical drug metabolite |
| Comments |
Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
261.028206325 u |
| Formula |
C13H11NOS2 |
| InChI |
InChI=1S/C13H11NOS2/c1-17(15)9-6-7-13-11(8-9)14-10-4-2-3-5-12(10)16-13/h2-8,14H,1H3 |
| InChIKey |
PKTNJPQVNOFHLC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
261.357 g/mol |
| Nominal Mass |
261 u |
| Quality |
767 |
| Retention Index |
1990 |
| SMILES |
C1=2NC=3C(SC2C=CC(=C1)S(=O)C)=CC=CC3 |
| SPLASH |
splash10-0002-2970000000-cab29891e3a0c6c8e0fb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-(methylsulfinyl)-10H-phenothiazine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009267 |
