| SpectraBase Spectrum ID |
BsjKhEda72m |
| Name |
Sertraline |
| Copyright |
Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
| Formula |
C17H17Cl2N |
| InChI |
InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17-/m0/s1 |
| InChIKey |
VGKDLMBJGBXTGI-SJCJKPOMSA-N |
| SMILES |
N([C@]1(CC[C@](c2ccccc12)(c1ccc(c(c1)Cl)Cl)[H])[H])C |
| SPLASH |
splash10-00b9-1690000000-96cb1909570d41119379 |
| Source of Spectrum |
Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |
