| SpectraBase Compound ID | CZMaqaEW5VE |
|---|---|
| InChI | InChI=1S/C14H10F3NO3/c1-20-13(19)11-6-3-7-18-12(11)21-10-5-2-4-9(8-10)14(15,16)17/h2-8H,1H3 |
| InChIKey | ZZLJRYFTUVISBQ-UHFFFAOYSA-N |
| Mol Weight | 297.23 g/mol |
| Molecular Formula | C14H10F3NO3 |
| Exact Mass | 297.061278 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J2ZuaZpr1xt |
|---|---|
| Name | Methyl 2-(3-(trifluoromethyl)phenoxy)nicotinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.061277672 u |
| Formula | C14H10F3NO3 |
| InChI | InChI=1S/C14H10F3NO3/c1-20-13(19)11-6-3-7-18-12(11)21-10-5-2-4-9(8-10)14(15,16)17/h2-8H,1H3 |
| InChIKey | ZZLJRYFTUVISBQ-UHFFFAOYSA-N |
| Molecular Weight | 297.233 g/mol |
| SMILES | C1(=NC=CC=C1C(OC)=O)OC1=CC=CC(=C1)C(F)(F)F |