| SpectraBase Spectrum ID |
1v8SB8Q1ya |
| Name |
Duloxetine isomer-1 AC |
| Classification |
Antidepressant |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
339.129300092 u |
| Formula |
C20H21NO2S |
| InChI |
InChI=1S/C20H21NO2S/c1-15(22)21(2)13-12-19(20-11-6-14-24-20)23-18-10-5-8-16-7-3-4-9-17(16)18/h3-11,14,19H,12-13H2,1-2H3 |
| InChIKey |
XVGRKIDSOPYVEU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
339.453 g/mol |
| SMILES |
c1cc2c(cc1)c(ccc2)OC(c1cccs1)CCN(C(C)=O)C |
| SPLASH |
splash10-000i-4791000000-cf060ab0eedb75e3bb77 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_7463 |
