| SpectraBase Compound ID | KZ1wxbtwt1t |
|---|---|
| InChI | InChI=1S/C8H6BrClO3/c9-6-3-5(10)1-2-7(6)13-4-8(11)12/h1-3H,4H2,(H,11,12) |
| InChIKey | IQFPVGBBDOCAMI-UHFFFAOYSA-N |
| Mol Weight | 265.49 g/mol |
| Molecular Formula | C8H6BrClO3 |
| Exact Mass | 263.918885 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LI8u6VX2Zik |
|---|---|
| Name | (2-Bromo-4-chlorophenoxy)acetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.918884750 u |
| Formula | C8H6BrClO3 |
| InChI | InChI=1S/C8H6BrClO3/c9-6-3-5(10)1-2-7(6)13-4-8(11)12/h1-3H,4H2,(H,11,12) |
| InChIKey | IQFPVGBBDOCAMI-UHFFFAOYSA-N |
| Molecular Weight | 265.490 g/mol |
| SMILES | C(COC1=C(C=C(C=C1)Cl)Br)(=O)O |