![5-[(2,3,5,6-Tetrafluorophenoxy)methyl]-2-furoic acid](/api/spectrum/GSdrTlcnanj/structure.png?h=300&w=458 "5-[(2,3,5,6-Tetrafluorophenoxy)methyl]-2-furoic acid")
| SpectraBase Compound ID | 82wliQaCwyz |
|---|---|
| InChI | InChI=1S/C12H6F4O4/c13-6-3-7(14)10(16)11(9(6)15)19-4-5-1-2-8(20-5)12(17)18/h1-3H,4H2,(H,17,18) |
| InChIKey | IUIPFSMKGPFVTN-UHFFFAOYSA-N |
| Mol Weight | 290.17 g/mol |
| Molecular Formula | C12H6F4O4 |
| Exact Mass | 290.020221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GSdrTlcnanj |
|---|---|
| Name | 5-[(2,3,5,6-Tetrafluorophenoxy)methyl]-2-furoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.020221321 u |
| Formula | C12H6F4O4 |
| InChI | InChI=1S/C12H6F4O4/c13-6-3-7(14)10(16)11(9(6)15)19-4-5-1-2-8(20-5)12(17)18/h1-3H,4H2,(H,17,18) |
| InChIKey | IUIPFSMKGPFVTN-UHFFFAOYSA-N |
| Molecular Weight | 290.170 g/mol |
| SMILES | OC(C=1OC(COC=2C(=C(F)C=C(C2F)F)F)=CC1)=O |