| SpectraBase Compound ID | 3QEgr0pHzIN |
|---|---|
| InChI | InChI=1S/C13H19NO/c1-4-5-12(14-3)13(15)11-8-6-10(2)7-9-11/h6-9,12,14H,4-5H2,1-3H3 |
| InChIKey | AKVKBEDACKJNPO-UHFFFAOYSA-N |
| Mol Weight | 205.3 g/mol |
| Molecular Formula | C13H19NO |
| Exact Mass | 205.146664 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2a8qkmDa8IA |
|---|---|
| Name | 4-Methylpentedrone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.146664235 u |
| Formula | C13H19NO |
| InChI | InChI=1S/C13H19NO/c1-4-5-12(14-3)13(15)11-8-6-10(2)7-9-11/h6-9,12,14H,4-5H2,1-3H3 |
| InChIKey | AKVKBEDACKJNPO-UHFFFAOYSA-N |
| Molecular Weight | 205.301 g/mol |
| SMILES | C(C(CCC)NC)(=O)C1=CC=C(C=C1)C |