| SpectraBase Spectrum ID |
ClQcAf6gEf8 |
| Name |
Metaclazepam-M (O-demethyl-) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C16H13BrClN2/c1-20-9-8-19-16(12-4-2-3-5-14(12)18)13-10-11(17)6-7-15(13)20/h2-7,9-10H,8H2,1H3/q+1 |
| InChIKey |
UIBRMZGKSMFKTF-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C=1CN=C(C2=C([N+]1C)C=CC(=C2)Br)C1=CC=CC=C1Cl |
| 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 |
