| SpectraBase Compound ID | 7RGZuYWR6by |
|---|---|
| InChI | InChI=1S/C11H10F3NO2/c1-2-6-17-10(16)15-9-5-3-4-8(7-9)11(12,13)14/h2-5,7H,1,6H2,(H,15,16) |
| InChIKey | IYSQDTPHQMKYNF-UHFFFAOYSA-N |
| Mol Weight | 245.2 g/mol |
| Molecular Formula | C11H10F3NO2 |
| Exact Mass | 245.066363 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CRX9nnBkqEF |
|---|---|
| Name | m-(Trifluoromethyl)carbanilic acid, allyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.066363053 u |
| Formula | C11H10F3NO2 |
| InChI | InChI=1S/C11H10F3NO2/c1-2-6-17-10(16)15-9-5-3-4-8(7-9)11(12,13)14/h2-5,7H,1,6H2,(H,15,16) |
| InChIKey | IYSQDTPHQMKYNF-UHFFFAOYSA-N |
| Molecular Weight | 245.201 g/mol |
| SMILES | C(F)(F)(F)C1=CC(=CC=C1)NC(OCC=C)=O |