| SpectraBase Compound ID | KL6wZSy7cV9 |
|---|---|
| InChI | InChI=1S/C18H26N4O2.2CH4O/c1-4-5-8-11-22-14-10-7-6-9-13(14)16(21-22)18(24)20-15(12(2)3)17(19)23;2*1-2/h6-7,9-10,12,15H,4-5,8,11H2,1-3H3,(H2,19,23)(H,20,24);2*2H,1H3 |
| InChIKey | CMQFCQBMRIPDOO-UHFFFAOYSA-N |
| Mol Weight | 394.52 g/mol |
| Molecular Formula | C20H34N4O4 |
| Exact Mass | 394.258006 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | FkiWCF8Cx8Y |
|---|---|
| Name | AB-PINACA-M (di-HO-) MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 363.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C18H26N4O4 |
| Ion Polarity | P |
| Ionization Type | ESI |
| 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 | ms2 |
| Technique | ITMS |