| SpectraBase Compound ID | 2dxm1S5nMwK |
|---|---|
| InChI | InChI=1S/C16H17NO/c18-16(15-9-3-1-4-10-15)11-5-8-14-17-12-6-2-7-13-17/h1,3-4,8-10,14H,2,6-7,12-13H2/b14-8+ |
| InChIKey | JPICSFUATSMDMO-RIYZIHGNSA-N |
| Mol Weight | 239.32 g/mol |
| Molecular Formula | C16H17NO |
| Exact Mass | 239.131014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9GidCzOputV |
|---|---|
| Name | 4-Penten-2-yn-1-one, 1-phenyl-5-(1-piperidinyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.131014170 u |
| Formula | C16H17NO |
| InChI | InChI=1S/C16H17NO/c18-16(15-9-3-1-4-10-15)11-5-8-14-17-12-6-2-7-13-17/h1,3-4,8-10,14H,2,6-7,12-13H2/b14-8+ |
| InChIKey | JPICSFUATSMDMO-RIYZIHGNSA-N |
| Molecular Weight | 239.318 g/mol |
| SMILES | C(#C\C=C\N1CCCCC1)C(=O)C=1C=CC=CC1 |