| SpectraBase Compound ID | JcLTyJLqjs1 |
|---|---|
| InChI | InChI=1S/C14H17NO/c15-9-8-12-6-7-13(10-14(12)16)11-4-2-1-3-5-11/h1-5,12-14,16H,6-8,10H2 |
| InChIKey | UILBRAQQMNPANN-UHFFFAOYSA-N |
| Mol Weight | 215.3 g/mol |
| Molecular Formula | C14H17NO |
| Exact Mass | 215.131014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5LfYzhaqR1p |
|---|---|
| Name | (2-Hydroxy-4-phenyl-cyclohexyl)acetonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.131014170 u |
| Formula | C14H17NO |
| InChI | InChI=1S/C14H17NO/c15-9-8-12-6-7-13(10-14(12)16)11-4-2-1-3-5-11/h1-5,12-14,16H,6-8,10H2 |
| InChIKey | UILBRAQQMNPANN-UHFFFAOYSA-N |
| Molecular Weight | 215.296 g/mol |
| SMILES | C(#N)CC1C(CC(C=2C=CC=CC2)CC1)O |