SpectraBase Spectrum ID |
JGziwARKZLE |
Name |
Chlorprothixene-M (Nor,-OH) AC |
Classification |
Pharmaceutical drug artifact derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
359.074677696 u |
Formula |
C19H18ClNO2S |
InChI |
InChI=1S/C19H18ClNO2S/c1-12(22)21(2)10-4-5-14-15-11-13(20)8-9-17(15)24-18-7-3-6-16(23)19(14)18/h3,5-9,11,23H,4,10H2,1-2H3/b14-5+ |
InChIKey |
VELJTWLHLHTZLB-LHHJGKSTSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
359.871 g/mol |
Nominal Mass |
359 u |
Quality |
918 |
Retention Index |
2651 |
SMILES |
OC1=C2\C(C3=C(SC2=CC=C1)C=CC(=C3)Cl)=C\CCN(C(=O)C)C |
SPLASH |
splash10-05fr-1291000000-1c1eb390203a8f2663bb |
Sample Comments |
Acetyl position uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(3-((9E)-7-chloro-1-hydroxy-9H-thioxanthen-9-ylidene)propyl)-N-methylacetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_006231 |