SpectraBase Spectrum ID |
8FTKav1elIu |
Name |
lopenthixol TMS |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
472.177139099 u |
Formula |
C25H33ClN2OSSi |
InChI |
InChI=1S/C25H33ClN2OSSi/c1-31(2,3)29-18-17-28-15-13-27(14-16-28)12-6-8-21-22-7-4-5-9-24(22)30-25-11-10-20(26)19-23(21)25/h4-5,7-11,19H,6,12-18H2,1-3H3/b21-8- |
InChIKey |
KTBLRMSCTVEYIN-WNFQYIGGSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
473.150 g/mol |
Nominal Mass |
472 u |
Quality |
933 |
Retention Index |
3512 |
SMILES |
C1=2\C(C=3C(SC2C=CC(=C1)Cl)=CC=CC3)=C/CCN1CCN(CC1)CCO[Si](C)(C)C |
SPLASH |
splash10-01b9-4290000000-578af2e650ae102b06df |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(3-(-2-Chloro-9H-thioxanthen-9-ylidene)propyl)-4-(2-((trimethylsilyl)oxy)ethyl)piperazine |
Technique |
GC/MS |
Wiley ID |
DD2024_031726 |