| SpectraBase Compound ID | 4mF4preKGc1 |
|---|---|
| InChI | InChI=1S/C9H9NO/c11-7-2-1-4-9-5-3-6-10-8-9/h3,5-6,8,11H,2,7H2 |
| InChIKey | GTWACVFJDRATJU-UHFFFAOYSA-N |
| Mol Weight | 147.18 g/mol |
| Molecular Formula | C9H9NO |
| Exact Mass | 147.068414 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 | 4buu4kHI3mp |
|---|---|
| Name | 4-(Pyridin-3'-yl)but-3-yn-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.068413913 u |
| Formula | C9H9NO |
| InChI | InChI=1S/C9H9NO/c11-7-2-1-4-9-5-3-6-10-8-9/h3,5-6,8,11H,2,7H2 |
| InChIKey | GTWACVFJDRATJU-UHFFFAOYSA-N |
| Molecular Weight | 147.177 g/mol |
| SMILES | C(#CCCO)C1=CN=CC=C1 |