| SpectraBase Compound ID | I8SkyZEbwv4 |
|---|---|
| InChI | InChI=1S/C16H13NO/c18-16(15-11-5-2-6-12-15)17-13-7-10-14-8-3-1-4-9-14/h1-6,8-9,11-12H,13H2,(H,17,18) |
| InChIKey | WGKREOIZCZCAIA-UHFFFAOYSA-N |
| Mol Weight | 235.29 g/mol |
| Molecular Formula | C16H13NO |
| Exact Mass | 235.099714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GaTypAp878k |
|---|---|
| Name | N-(3-Phenylprop-2-ynyl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.099714042 u |
| Formula | C16H13NO |
| InChI | InChI=1S/C16H13NO/c18-16(15-11-5-2-6-12-15)17-13-7-10-14-8-3-1-4-9-14/h1-6,8-9,11-12H,13H2,(H,17,18) |
| InChIKey | WGKREOIZCZCAIA-UHFFFAOYSA-N |
| Molecular Weight | 235.286 g/mol |
| SMILES | C(C1=CC=CC=C1)(=O)NCC#CC=1C=CC=CC1 |