| SpectraBase Spectrum ID |
I1WG0tTPfsb |
| Name |
Bemetizide MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 402.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H17ClN3O4S2 |
| InChI |
InChI=1S/C15H16ClN3O4S2/c1-9(10-5-3-2-4-6-10)15-18-12-7-11(16)13(24(17,20)21)8-14(12)25(22,23)19-15/h2-9,15,18-19H,1H3,(H2-,17,20,21)/p+1 |
| InChIKey |
KHNIBTCPNVKQOP-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N1C2=CC(=C([S+](O)(N)=O)C=C2S(NC1C(C1=CC=CC=C1)C)(=O)=O)Cl |
| 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 |
