| SpectraBase Spectrum ID |
JH9PxOJ92mm |
| Name |
Chlorprothixene-M (Nor,OH,Oxo) AC I |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
373.053942250 u |
| Formula |
C19H16ClNO3S |
| InChI |
InChI=1S/C19H16ClNO3S/c1-11(22)21(2)10-14(24)9-15-16-7-12(20)3-5-18(16)25-19-6-4-13(23)8-17(15)19/h3-9,23H,10H2,1-2H3/b15-9+ |
| InChIKey |
MXZFECRDLCQGAL-OQLLNIDSSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
373.854 g/mol |
| Nominal Mass |
373 u |
| Quality |
929 |
| Retention Index |
2748 |
| SMILES |
OC=1C=C2\C(C3=C(SC2=CC1)C=CC(=C3)Cl)=C\C(CN(C(=O)C)C)=O |
| SPLASH |
splash10-0a4i-9030000000-25fa80d9a589a58d27e7 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(3-(2-chloro-7-hydroxy-9H-thioxanthen-9-ylidene)-2-oxopropyl)-N-methylacetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000666 |
