| SpectraBase Compound ID | 18cWgEsDObo |
|---|---|
| InChI | InChI=1S/C9H11NO2/c1-2-12-7-9(11)8-5-3-4-6-10-8/h3-6H,2,7H2,1H3 |
| InChIKey | GYBYCIGPGDVYAP-UHFFFAOYSA-N |
| Mol Weight | 165.19 g/mol |
| Molecular Formula | C9H11NO2 |
| Exact Mass | 165.078979 g/mol |
| SpectraBase Spectrum ID | JlTXbXN9FjM |
|---|---|
| Name | 2-Ethoxy-1-(2-pyridinyl)ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 165.078978596 u |
| Formula | C9H11NO2 |
| InChI | InChI=1S/C9H11NO2/c1-2-12-7-9(11)8-5-3-4-6-10-8/h3-6H,2,7H2,1H3 |
| InChIKey | GYBYCIGPGDVYAP-UHFFFAOYSA-N |
| Molecular Weight | 165.192 g/mol |
| SMILES | C=1(C=CC=CN1)C(=O)COCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914615 |