| SpectraBase Compound ID | AJcohelK8aP |
|---|---|
| InChI | InChI=1S/C15H19NO2/c16-12-6-4-8-14(17)9-5-7-13-18-15-10-2-1-3-11-15/h1-3,10-11H,4-9,13H2 |
| InChIKey | USGGCYYQIVYRFT-UHFFFAOYSA-N |
| Mol Weight | 245.32 g/mol |
| Molecular Formula | C15H19NO2 |
| Exact Mass | 245.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Bk1mC1Be5U |
|---|---|
| Name | 5-oxo-9-Phenoxynonanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.141578854 u |
| Formula | C15H19NO2 |
| InChI | InChI=1S/C15H19NO2/c16-12-6-4-8-14(17)9-5-7-13-18-15-10-2-1-3-11-15/h1-3,10-11H,4-9,13H2 |
| InChIKey | USGGCYYQIVYRFT-UHFFFAOYSA-N |
| Molecular Weight | 245.322 g/mol |
| SMILES | C(CC(=O)CCCC#N)CCOC1=CC=CC=C1 |