| SpectraBase Spectrum ID |
62npBtc8lGu |
| Name |
4-MTA-M (sulfone-acetyl-) MS3_2 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-210.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C10H13O2S/c1-3-4-9-5-7-10(8-6-9)13(2,11)12/h3,5-8H,4H2,1-2H3/q+1 |
| InChIKey |
PRNUUZBQXSWATB-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[CH+](CC=1C=CC(=CC1)S(C)(=O)=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 |
ms3 |
| Technique |
ITMS |
