SpectraBase Spectrum ID |
7KBpkGqROTL |
Name |
Haloperidol TMS |
Classification |
Pharmaceutical drug derivative |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
447.179661638 u |
Formula |
C24H31ClFNO2Si |
InChI |
InChI=1S/C24H31ClFNO2Si/c1-30(2,3)29-24(20-8-10-21(25)11-9-20)14-17-27(18-15-24)16-4-5-23(28)19-6-12-22(26)13-7-19/h6-13H,4-5,14-18H2,1-3H3 |
InChIKey |
GANQAEPVTSXCFF-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
448.053 g/mol |
Nominal Mass |
447 u |
Quality |
921 |
Retention Index |
3273 |
SMILES |
C1(C2=CC=C(C=C2)Cl)(O[Si](C)(C)C)CCN(CC1)CCCC(C1=CC=C(C=C1)F)=O |
SPLASH |
splash10-0avi-4983000000-b98f9028024e5244d89c |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
4-(4-(4-chlorophenyl)-4-((trimethylsilyl)oxy)piperidin-1-yl)-1-(4-fluorophenyl)butan-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_014040 |