| SpectraBase Spectrum ID |
99bUyXHuPA |
| Name |
Chlorprothixene-M (nor-HO-) isomer 2 MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 318.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C17H16ClNOS |
| InChI |
InChI=1S/C17H16ClNOS/c1-19-17(20)9-7-12-13-4-2-3-5-15(13)21-16-8-6-11(18)10-14(12)16/h2-8,10,17,19-20H,9H2,1H3/b12-7+ |
| InChIKey |
XTNNGGMOZILIPG-KPKJPENVSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C(C\C=C/1C2=C(C=CC=C2)SC2=CC=C(Cl)C=C12)O)C |
| Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description |
Analyte Type: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
