| SpectraBase Compound ID | l8K8O7Oj6Z |
|---|---|
| InChI | InChI=1S/C18H25ClN4O2.CH4O/c1-12(2)15(17(20)24)21-18(25)16-13-8-4-5-9-14(13)23(22-16)11-7-3-6-10-19;1-2/h4-5,8-9,12,15H,3,6-7,10-11H2,1-2H3,(H2,20,24)(H,21,25);2H,1H3 |
| InChIKey | DLDLTANVMFJPEQ-UHFFFAOYSA-N |
| Mol Weight | 396.92 g/mol |
| Molecular Formula | C19H29ClN4O3 |
| Exact Mass | 396.192819 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | A38oSahqoPy |
|---|---|
| Name | 5-Cl-AB-PINACA-M (HO-) isomer 1 MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 381.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C18H25ClN4O3 |
| 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 |