![5-[(4-Bromophenoxy)methyl]-2-furoic acid](/api/spectrum/Iq00ktjc4DH/structure.png?h=300&w=458 "5-[(4-Bromophenoxy)methyl]-2-furoic acid")
| SpectraBase Compound ID | dxHqYO9yv |
|---|---|
| InChI | InChI=1S/C12H9BrO4/c13-8-1-3-9(4-2-8)16-7-10-5-6-11(17-10)12(14)15/h1-6H,7H2,(H,14,15) |
| InChIKey | OPOBLZKJGHHTAA-UHFFFAOYSA-N |
| Mol Weight | 297.1 g/mol |
| Molecular Formula | C12H9BrO4 |
| Exact Mass | 295.968422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Iq00ktjc4DH |
|---|---|
| Name | 5-[(4-Bromophenoxy)methyl]-2-furoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.968421766 u |
| Formula | C12H9BrO4 |
| InChI | InChI=1S/C12H9BrO4/c13-8-1-3-9(4-2-8)16-7-10-5-6-11(17-10)12(14)15/h1-6H,7H2,(H,14,15) |
| InChIKey | OPOBLZKJGHHTAA-UHFFFAOYSA-N |
| Molecular Weight | 297.104 g/mol |
| SMILES | OC(C=1OC(COC2=CC=C(C=C2)Br)=CC1)=O |