| SpectraBase Spectrum ID |
Dkd1Mk8Oyrw |
| Name |
MDMB-4en-5Cl-PINACA |
| Classification |
Indazole cannabinoid designer drug |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
391.166269406 u |
| Formula |
C20H26ClN3O3 |
| InChI |
InChI=1S/C20H26ClN3O3/c1-6-7-8-11-24-15-10-9-13(21)12-14(15)16(23-24)18(25)22-17(19(26)27-5)20(2,3)4/h6,9-10,12,17H,1,7-8,11H2,2-5H3,(H,22,25)/t17-/m1/s1 |
| InChIKey |
FUHVLXJIHIWWIH-QGZVFWFLSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
391.899 g/mol |
| Nominal Mass |
391 u |
| Quality |
968 |
| Retention Index |
2991 |
| SMILES |
[C@@](NC(C=1C=2C(N(N1)CCCC=C)=CC=C(C2)Cl)=O)(C(C)(C)C)(C(OC)=O)[H] |
| SPLASH |
splash10-0002-3692000000-5bb05173f4c35965c28d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl (2S)-2-(((5-chloro-1-(pent-4-en-1-yl)-1H-indazol-3-yl)carbonyl)amino)-3,3-dimethylbutanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034996 |
