SpectraBase Spectrum ID |
3MQhhZl3aa |
Name |
Homofenazine |
CAS Registry Number |
3833-99-6 |
Classification |
Pharmaceutical drug, anxiolytic, antipsychotic |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
451.190518196 u |
Formula |
C23H28F3N3OS |
InChI |
InChI=1S/C23H28F3N3OS/c24-23(25,26)18-7-8-22-20(17-18)29(19-5-1-2-6-21(19)31-22)12-4-11-27-9-3-10-28(14-13-27)15-16-30/h1-2,5-8,17,30H,3-4,9-16H2 |
InChIKey |
LOHNHQLZFYCAEQ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
451.552 g/mol |
Nominal Mass |
451 u |
Quality |
921 |
Retention Index |
3501 |
SMILES |
OCCN1CCN(CCCN2C3=C(SC=4C2=CC=CC4)C=CC(=C3)C(F)(F)F)CCC1 |
SPLASH |
splash10-05o3-9420000000-c661fcabc4740a4d602b |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-[4-[3-[2-(Trifluoromethyl)phenothiazin-10-yl]propyl]-1,4-diazepan-1-yl]ethanol |
Technique |
GC/MS |
Wiley ID |
DD2024_001620 |