| SpectraBase Compound ID | LSlUMgrW422 |
|---|---|
| InChI | InChI=1S/C7H9NO/c1-2-7-4-3-5-8(9)6-7/h3-6H,2H2,1H3 |
| InChIKey | WHLDRJCCCXVISS-UHFFFAOYSA-N |
| Mol Weight | 123.15 g/mol |
| Molecular Formula | C7H9NO |
| Exact Mass | 123.068414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KhZrPxCQASP |
|---|---|
| Name | Pyridine, 3-ethyl-, 1-oxide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 123.068413913 u |
| Formula | C7H9NO |
| InChI | InChI=1S/C7H9NO/c1-2-7-4-3-5-8(9)6-7/h3-6H,2H2,1H3 |
| InChIKey | WHLDRJCCCXVISS-UHFFFAOYSA-N |
| Molecular Weight | 123.155 g/mol |
| SMILES | CCC1=CN(=O)=CC=C1 |