SpectraBase Spectrum ID |
2Usmw5eteb |
Name |
Metizolam MS3_1 |
Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [70.00-315.00] |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C14H9ClN4S |
InChI |
InChI=1S/C11H13O2/c1-2-10-4-6-11(7-5-10)13-9-3-8-12/h2,4-8,12H,1,3,9H2/q+1 |
InChIKey |
DELIUGMKPXGIIL-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
O[CH+]CCOC=1C=CC(C=C)=CC1 |
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 |