| SpectraBase Compound ID | DfvFsUdLX2j |
|---|---|
| InChI | InChI=1S/C12H12F2O3/c13-9-4-1-5-10(14)11(9)12(15)17-7-8-3-2-6-16-8/h1,4-5,8H,2-3,6-7H2 |
| InChIKey | FMTRYEXCYROAQN-UHFFFAOYSA-N |
| Mol Weight | 242.22 g/mol |
| Molecular Formula | C12H12F2O3 |
| Exact Mass | 242.075451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CSGjrzGt5JZ |
|---|---|
| Name | 2,6-Difluorobenzoic acid, 2-tetrahydrofurylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.075450569 u |
| Formula | C12H12F2O3 |
| InChI | InChI=1S/C12H12F2O3/c13-9-4-1-5-10(14)11(9)12(15)17-7-8-3-2-6-16-8/h1,4-5,8H,2-3,6-7H2 |
| InChIKey | FMTRYEXCYROAQN-UHFFFAOYSA-N |
| Molecular Weight | 242.222 g/mol |
| SMILES | C1(OCCC1)COC(C1=C(C=CC=C1F)F)=O |