| SpectraBase Spectrum ID |
2mrjMRh4mGm |
| Name |
Duloxetin 2AC |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
381.139864776 u |
| Formula |
C22H23NO3S |
| InChI |
InChI=1S/C22H23NO3S/c1-15(24)18-13-22(27-14-18)21(11-12-23(3)16(2)25)26-20-10-6-8-17-7-4-5-9-19(17)20/h4-10,13-14,21H,11-12H2,1-3H3/t21-/m0/s1 |
| InChIKey |
MEPAQELRCQQECX-NRFANRHFSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
381.490 g/mol |
| Nominal Mass |
381 u |
| Quality |
933 |
| Retention Index |
3021 |
| SMILES |
C=1(C2=C(C=CC1)C=CC=C2)O[C@](C1=CC(=CS1)C(=O)C)(CCN(C(=O)C)C)[H] |
| SPLASH |
splash10-000l-8692000000-142641696564f458028c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-((3S)-3-(4-acetylthiophen-2-yl)-3-(naphthalen-1-yloxy)propyl)-N-methylacetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011700 |
