| SpectraBase Spectrum ID |
2eCKrNMGJ6 |
| Name |
Sertraline-M (HO-ketone) AC |
| Classification |
Antidepressant |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
348.031999708 u |
| Formula |
C18H14Cl2O3 |
| InChI |
InChI=1S/C18H14Cl2O3/c1-10(21)23-16-9-14(12-7-4-8-15(19)17(12)20)11-5-2-3-6-13(11)18(16)22/h2-8,14,16H,9H2,1H3 |
| InChIKey |
XCFZEODPNSEIAU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
349.213 g/mol |
| SMILES |
C1(c2c(C(=O)C(C1)OC(=O)C)cccc2)c1c(c(Cl)ccc1)Cl |
| SPLASH |
splash10-03dr-0191000000-c830e03bb20be577ec78 |
| 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. |
| Sample Preparation Procedure |
Detected: UHYAC |
| 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_5311 |
