SpectraBase Spectrum ID |
JJXfLO2ovz6 |
Name |
Lofepramine |
CAS Registry Number |
23047-25-8 |
Classification |
Pharmaceutical drug, sympathomimetic, antidepressant |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
418.181191196 u |
Formula |
C26H27ClN2O |
InChI |
InChI=1S/C26H27ClN2O/c1-28(19-26(30)22-13-15-23(27)16-14-22)17-6-18-29-24-9-4-2-7-20(24)11-12-21-8-3-5-10-25(21)29/h2-5,7-10,13-16H,6,11-12,17-19H2,1H3 |
InChIKey |
SAPNXPWPAUFAJU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
418.968 g/mol |
Nominal Mass |
418 u |
Quality |
991 |
Retention Index |
3247 |
SMILES |
C=12N(C3=C(CCC2=CC=CC1)C=CC=C3)CCCN(CC(C=1C=CC(=CC1)Cl)=O)C |
SPLASH |
splash10-0a4i-9210000000-8656e4cda94f7b0a606d |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
4'-Chloro-2-[3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)-N-methylpropylamino]acetophenone |
Technique |
GC/MS |
Wiley ID |
DD2024_001851 |