| SpectraBase Spectrum ID |
8IWWctqr2Rs |
| Name |
Quetiapine-M (N-Ethyl,desulfo) |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
291.173547688 u |
| Formula |
C19H21N3 |
| InChI |
InChI=1S/C19H21N3/c1-2-21-11-13-22(14-12-21)19-17-9-4-3-7-15(17)16-8-5-6-10-18(16)20-19/h3-10H,2,11-14H2,1H3 |
| InChIKey |
CVGOKWFXCKYZQQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
291.398 g/mol |
| Nominal Mass |
291 u |
| Quality |
894 |
| Retention Index |
2450 |
| SMILES |
C=12C(N3CCN(CC3)CC)=NC=3C(C1C=CC=C2)=CC=CC3 |
| SPLASH |
splash10-0a4i-2590000000-2a7bc5ca4fd2cfa64045 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6-(4-ethylpiperazin-1-yl)phenanthridine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009297 |
