| SpectraBase Compound ID | IbcnxE8tGZD |
|---|---|
| InChI | InChI=1S/C10H15NO/c11-7-2-1-4-9-5-3-6-10(12)8-9/h9H,1-6,8H2 |
| InChIKey | LBNXUJAXQZAJIU-UHFFFAOYSA-N |
| Mol Weight | 165.24 g/mol |
| Molecular Formula | C10H15NO |
| Exact Mass | 165.115364 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 | 9UsPcjSKHQf |
|---|---|
| Name | 4-(3-Ketocyclohexyl)butyronitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 165.115364106 u |
| Formula | C10H15NO |
| InChI | InChI=1S/C10H15NO/c11-7-2-1-4-9-5-3-6-10(12)8-9/h9H,1-6,8H2 |
| InChIKey | LBNXUJAXQZAJIU-UHFFFAOYSA-N |
| Molecular Weight | 165.236 g/mol |
| SMILES | C(#N)CCCC1CC(=O)CCC1 |