| SpectraBase Compound ID | 8I6J4voa8Lo |
|---|---|
| InChI | InChI=1S/C17H16N2O2/c20-17-15-9-5-4-6-13(15)10-11-19(17)12-16(18-21)14-7-2-1-3-8-14/h1-9,21H,10-12H2/b18-16- |
| InChIKey | QXYSMZPJTPWQDV-VLGSPTGOSA-N |
| Mol Weight | 280.33 g/mol |
| Molecular Formula | C17H16N2O2 |
| Exact Mass | 280.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2xHer6zmJqb |
|---|---|
| Name | (Z)-2-(2-Hydroximino-2-phenylethyl)-1,2,3,4-tetrahydro-1-isoquinolinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.121177761 u |
| Formula | C17H16N2O2 |
| InChI | InChI=1S/C17H16N2O2/c20-17-15-9-5-4-6-13(15)10-11-19(17)12-16(18-21)14-7-2-1-3-8-14/h1-9,21H,10-12H2/b18-16- |
| InChIKey | QXYSMZPJTPWQDV-VLGSPTGOSA-N |
| SMILES | C1=CC=C2C(=C1)C(N(CC2)C\C(=N\O)C1=CC=CC=C1)=O |