| SpectraBase Compound ID | Cuy6ClAKz6g |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-11(2,3)8-14-10(13)9-4-6-12-7-5-9/h4-7H,8H2,1-3H3 |
| InChIKey | AYJICZOOGKSEPV-UHFFFAOYSA-N |
| Mol Weight | 193.25 g/mol |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GtOPs8ey5Bj |
|---|---|
| Name | Isonicotinic acid, 2,2-dimethylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.110278725 u |
| Formula | C11H15NO2 |
| InChI | InChI=1S/C11H15NO2/c1-11(2,3)8-14-10(13)9-4-6-12-7-5-9/h4-7H,8H2,1-3H3 |
| InChIKey | AYJICZOOGKSEPV-UHFFFAOYSA-N |
| Molecular Weight | 193.246 g/mol |
| SMILES | C1=NC=CC(=C1)C(OCC(C)(C)C)=O |