| SpectraBase Compound ID | 4ThLZH23H0D |
|---|---|
| InChI | InChI=1S/C10H11NO/c1-11(8-5-9-12)10-6-3-2-4-7-10/h2-9H,1H3/b8-5+ |
| InChIKey | YLMOTKLYENPQLK-VMPITWQZSA-N |
| Mol Weight | 161.2 g/mol |
| Molecular Formula | C10H11NO |
| Exact Mass | 161.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9lO9g7zkYMN |
|---|---|
| Name | 2-Propenal, 3-(methylphenylamino)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 161.084063977 u |
| Formula | C10H11NO |
| InChI | InChI=1S/C10H11NO/c1-11(8-5-9-12)10-6-3-2-4-7-10/h2-9H,1H3/b8-5+ |
| InChIKey | YLMOTKLYENPQLK-VMPITWQZSA-N |
| Molecular Weight | 161.204 g/mol |
| SMILES | C1(=CC=CC=C1)N(\C=C\C=O)C |