| SpectraBase Compound ID | 4JLLo51mkfX |
|---|---|
| InChI | InChI=1S/C14H13NO2/c1-17-13-7-9(8-16)6-11-10-4-2-3-5-12(10)15-14(11)13/h2-7,15-16H,8H2,1H3 |
| InChIKey | KNKVHLASDDREQS-UHFFFAOYSA-N |
| Mol Weight | 227.26 g/mol |
| Molecular Formula | C14H13NO2 |
| Exact Mass | 227.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JWKuiwBYZYH |
|---|---|
| Name | Koenoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.094628661 u |
| Formula | C14H13NO2 |
| InChI | InChI=1S/C14H13NO2/c1-17-13-7-9(8-16)6-11-10-4-2-3-5-12(10)15-14(11)13/h2-7,15-16H,8H2,1H3 |
| InChIKey | KNKVHLASDDREQS-UHFFFAOYSA-N |
| Molecular Weight | 227.263 g/mol |
| SMILES | C=12NC=3C=CC=CC3C1C=C(C=C2OC)CO |