| SpectraBase Spectrum ID |
tOOhoeQXQ |
| Name |
Loratadine-M/A (-COOC2H5) AC |
| Classification |
Pharmaceutical drug metabolite derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
352.134241003 u |
| Formula |
C21H21ClN2O |
| InChI |
InChI=1S/C21H21ClN2O/c1-14(25)24-11-8-15(9-12-24)20-19-7-6-18(22)13-17(19)5-4-16-3-2-10-23-21(16)20/h2-3,6-7,10,13H,4-5,8-9,11-12H2,1H3 |
| InChIKey |
FLTBEMVEAFMWDD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
352.865 g/mol |
| Nominal Mass |
352 u |
| Quality |
934 |
| Retention Index |
2763 |
| SMILES |
C1(C2=C(CCC3=C1N=CC=C3)C=C(C=C2)Cl)=C1CCN(CC1)C(=O)C |
| SPLASH |
splash10-0gc3-0292000000-ec9d878900ea335b55ca |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidin-1-yl)ethan-1-\rone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007845 |
