| SpectraBase Compound ID | CwWhjKbC1DE |
|---|---|
| InChI | InChI=1S/C13H18N2O2/c1-8-6-5-7-9(2)12(8)15-13(17)10(3)14-11(4)16/h5-7,10H,1-4H3,(H,14,16)(H,15,17) |
| InChIKey | GEHWZSUZEPBZNQ-UHFFFAOYSA-N |
| Mol Weight | 234.3 g/mol |
| Molecular Formula | C13H18N2O2 |
| Exact Mass | 234.136828 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2HyyA40vNzz |
|---|---|
| Name | Tocainide ac |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.136827826 u |
| Formula | C13H18N2O2 |
| InChI | InChI=1S/C13H18N2O2/c1-8-6-5-7-9(2)12(8)15-13(17)10(3)14-11(4)16/h5-7,10H,1-4H3,(H,14,16)(H,15,17) |
| InChIKey | GEHWZSUZEPBZNQ-UHFFFAOYSA-N |
| Molecular Weight | 234.299 g/mol |
| SMILES | C1(NC(C(NC(=O)C)C)=O)=C(C=CC=C1C)C |