| SpectraBase Spectrum ID |
JEmwmbEA0Ce |
| Name |
Chlorprothixene-M (-C2H6N,Oxo) AC |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
328.032478531 u |
| Formula |
C18H13ClO2S |
| InChI |
InChI=1S/C18H13ClO2S/c1-12(20)21-10-4-6-14-15-5-2-3-7-17(15)22-18-9-8-13(19)11-16(14)18/h2-11H,1H3/b10-4+,14-6- |
| InChIKey |
HHARVOPGFYVOOZ-XZTVKCDHSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
328.813 g/mol |
| Nominal Mass |
328 u |
| Quality |
903 |
| Retention Index |
2368 |
| SMILES |
C1=2\C(C=3C(SC2C=CC(=C1)Cl)=CC=CC3)=C/C=C/OC(=O)C |
| SPLASH |
splash10-00xr-0290000000-b241500267748a20466e |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(2-chloro-9H-thioxanthen-9-ylidene)prop-1-en-1-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000662 |
