| SpectraBase Compound ID | I2g38X8KKqK |
|---|---|
| InChI | InChI=1S/C14H12N2O2/c1-9(2)14(17)18-12-5-3-4-10-6-7-11(8-15)16-13(10)12/h3-7,9H,1-2H3 |
| InChIKey | FGJPWRQPISWKNJ-UHFFFAOYSA-N |
| Mol Weight | 240.26 g/mol |
| Molecular Formula | C14H12N2O2 |
| Exact Mass | 240.089878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1LPmjDjqPV0 |
|---|---|
| Name | 2-Carbonitrile-8-hydroxyquinoline, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.089877632 u |
| Formula | C14H12N2O2 |
| InChI | InChI=1S/C14H12N2O2/c1-9(2)14(17)18-12-5-3-4-10-6-7-11(8-15)16-13(10)12/h3-7,9H,1-2H3 |
| InChIKey | FGJPWRQPISWKNJ-UHFFFAOYSA-N |
| Molecular Weight | 240.262 g/mol |
| SMILES | C12=NC(=CC=C2C=CC=C1OC(C(C)C)=O)C#N |