| SpectraBase Spectrum ID |
GY5OJfwCERE |
| Name |
Tiapride MS2 |
| CAS Registry Number |
51012-32-9 |
| Comments |
T: ITMS + c ESI d w Full ms2 [email protected] [80.00-340.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H24N2O4S |
| InChI |
InChI=1S/C15H24N2O4S/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18) |
| InChIKey |
JTVPZMFULRWINT-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(CCN(CC)CC)C(C1=C(OC)C=CC(=C1)S(C)(=O)=O)=O |
| 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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
