| SpectraBase Spectrum ID |
Kv5rhJu4CCv |
| Name |
5-Cl-AB-PINACA-M (HO-) isomer 2 MS3_2 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [70.00-320.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C16H20ClN3O/c1-2-11-18-16(21)15-13-8-4-5-9-14(13)20(19-15)12-7-3-6-10-17/h2,4-5,8-9H,3,6-7,10-12H2,1H3/p+1 |
| InChIKey |
GEMNDXLVIZNOPF-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C(C=1C2=C(C=CC=C2)N(N1)CCCCCCl)=O)C[CH+]C |
| 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 |
