| SpectraBase Compound ID | 6FTuATmwTvf |
|---|---|
| InChI | InChI=1S/C13H11NO3/c1-16-10-5-7-11(8-6-10)17-13(15)12-4-2-3-9-14-12/h2-9H,1H3 |
| InChIKey | OUJBZEYKOMREBA-UHFFFAOYSA-N |
| Mol Weight | 229.23 g/mol |
| Molecular Formula | C13H11NO3 |
| Exact Mass | 229.073893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CgTqAS7VDYb |
|---|---|
| Name | 4-Methoxyphenyl picolinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.073893215 u |
| Formula | C13H11NO3 |
| InChI | InChI=1S/C13H11NO3/c1-16-10-5-7-11(8-6-10)17-13(15)12-4-2-3-9-14-12/h2-9H,1H3 |
| InChIKey | OUJBZEYKOMREBA-UHFFFAOYSA-N |
| Molecular Weight | 229.235 g/mol |
| SMILES | C=1(C=CC(OC(C2=NC=CC=C2)=O)=CC1)OC |