| SpectraBase Compound ID | 3cVAEiqiY9 |
|---|---|
| InChI | InChI=1S/C12H11NO/c14-12-6-4-10(5-7-12)9-11-3-1-2-8-13-11/h1-8,14H,9H2 |
| InChIKey | FYKBHPFNYWJDFQ-UHFFFAOYSA-N |
| Mol Weight | 185.23 g/mol |
| Molecular Formula | C12H11NO |
| Exact Mass | 185.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2PC1wXq1zep |
|---|---|
| Name | Phenol, 4-(2-pyridinylmethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 185.084063977 u |
| Formula | C12H11NO |
| InChI | InChI=1S/C12H11NO/c14-12-6-4-10(5-7-12)9-11-3-1-2-8-13-11/h1-8,14H,9H2 |
| InChIKey | FYKBHPFNYWJDFQ-UHFFFAOYSA-N |
| Molecular Weight | 185.226 g/mol |
| SMILES | C1=CC=NC(=C1)CC1=CC=C(O)C=C1 |