| SpectraBase Compound ID | AP3UWsODHOP |
|---|---|
| InChI | InChI=1S/C9H6Br2O4/c10-6-1-5(3-12)9(7(11)2-6)15-4-8(13)14/h1-3H,4H2,(H,13,14) |
| InChIKey | UPCHNCWGIZOTFS-UHFFFAOYSA-N |
| Mol Weight | 337.95 g/mol |
| Molecular Formula | C9H6Br2O4 |
| Exact Mass | 335.863285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ddoYjd6yLj |
|---|---|
| Name | (2,4-Dibromo-6-formylphenoxy)acetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 335.863284669 u |
| Formula | C9H6Br2O4 |
| InChI | InChI=1S/C9H6Br2O4/c10-6-1-5(3-12)9(7(11)2-6)15-4-8(13)14/h1-3H,4H2,(H,13,14) |
| InChIKey | UPCHNCWGIZOTFS-UHFFFAOYSA-N |
| Molecular Weight | 337.951 g/mol |
| SMILES | OC(COC1=C(C=C(C=C1C=O)Br)Br)=O |