| SpectraBase Spectrum ID |
93mLukS7LrT |
| Name |
Tiagabine MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-260.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C14H15S2/c1-4-5-12(13-10(2)6-8-15-13)14-11(3)7-9-16-14/h5-9H,1,4H2,2-3H3/q+1 |
| InChIKey |
UDHYWWDZEVJPJA-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[CH2+]CC=C(C=1SC=CC1C)C1=C(C=CS1)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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
