| SpectraBase Compound ID | 46sYzAc4wEH |
|---|---|
| InChI | InChI=1S/C18H19NO/c1-14-9-11-17(12-10-14)18(20)15(2)19(3)13-16-7-5-4-6-8-16/h4-12H,2,13H2,1,3H3 |
| InChIKey | XPKUWQSZKMYLHI-UHFFFAOYSA-N |
| Mol Weight | 265.36 g/mol |
| Molecular Formula | C18H19NO |
| Exact Mass | 265.146664 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IAfc2OjJbao |
|---|---|
| Name | N-Benzyl-N-methyl-4-methylcathinone-A (-2H) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.146664235 u |
| Formula | C18H19NO |
| InChI | InChI=1S/C18H19NO/c1-14-9-11-17(12-10-14)18(20)15(2)19(3)13-16-7-5-4-6-8-16/h4-12H,2,13H2,1,3H3 |
| InChIKey | XPKUWQSZKMYLHI-UHFFFAOYSA-N |
| Molecular Weight | 265.356 g/mol |
| SMILES | C(C(C=1C=CC(=CC1)C)=O)(N(CC=1C=CC=CC1)C)=C |