| SpectraBase Spectrum ID |
8Gqp7W0nslE |
| Name |
MDMB-CHMICA (3-methyl-valine homolog) |
| Classification |
Indolcarboxamide cannamimetic designer drug |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
497.325356873 u |
| Formula |
C29H43N3O4 |
| InChI |
InChI=1S/C29H43N3O4/c1-28(2,3)23(26(34)31-24(27(35)36-7)29(4,5)6)30-25(33)21-18-32(17-19-13-9-8-10-14-19)22-16-12-11-15-20(21)22/h11-12,15-16,18-19,23-24H,8-10,13-14,17H2,1-7H3,(H,30,33)(H,31,34) |
| InChIKey |
WOBCRBBLOOSDFB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
497.680 g/mol |
| Nominal Mass |
497 u |
| Quality |
981 |
| Retention Index |
3840 |
| SMILES |
C=1(C=2C(N(C1)CC1CCCCC1)=CC=CC2)C(NC(C(NC(C(C)(C)C)C(OC)=O)=O)C(C)(C)C)=O |
| SPLASH |
splash10-0006-1391000000-64b9f14a99f81357c71d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 2-((2-(((1-(cyclohexylmethyl)-1H-indol-3-yl)carbonyl)amino)-3,3-dimethylbutanoyl)amino)-\r3,3-dimethylbutanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022370 |
