| SpectraBase Compound ID | GIICxEaPIBO |
|---|---|
| InChI | InChI=1S/C15H21NO2/c1-3-14(17)9-10-15(18)11-12(2)16-13-7-5-4-6-8-13/h4-8,11,14,16-17H,3,9-10H2,1-2H3/b12-11+ |
| InChIKey | RKKCSZXMGFDSIU-VAWYXSNFSA-N |
| Mol Weight | 247.34 g/mol |
| Molecular Formula | C15H21NO2 |
| Exact Mass | 247.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6yfXx0KsBRT |
|---|---|
| Name | 7-Hydroxy-2-(N-phenylamino)non-2-en-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.157228918 u |
| Formula | C15H21NO2 |
| InChI | InChI=1S/C15H21NO2/c1-3-14(17)9-10-15(18)11-12(2)16-13-7-5-4-6-8-13/h4-8,11,14,16-17H,3,9-10H2,1-2H3/b12-11+ |
| InChIKey | RKKCSZXMGFDSIU-VAWYXSNFSA-N |
| Molecular Weight | 247.338 g/mol |
| SMILES | C1(N\C(=C\C(=O)CCC(O)CC)C)=CC=CC=C1 |