| SpectraBase Spectrum ID |
ICDijotVWW |
| Name |
AB-CHMINACA artifact (deamino-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 340.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C20H26N3O2 |
| InChI |
InChI=1S/C20H25N3O2/c1-14(2)17(13-24)21-20(25)19-16-10-6-7-11-18(16)23(22-19)12-15-8-4-3-5-9-15/h6-7,10-11,14-15,17H,3-5,8-9,12H2,1-2H3/p+1 |
| InChIKey |
BZRJGUWQSCBAEJ-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C(C=1C2=C(C=CC=C2)N(N1)CC1CCCCC1)=O)C([C+]=O)C(C)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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
