| SpectraBase Compound ID | KTnSp5IV5W8 |
|---|---|
| InChI | InChI=1S/C8H3Cl2F3O2/c9-4-1-5(10)3-6(2-4)15-7(14)8(11,12)13/h1-3H |
| InChIKey | JAEYFRGCFZVNRY-UHFFFAOYSA-N |
| Mol Weight | 259.01 g/mol |
| Molecular Formula | C8H3Cl2F3O2 |
| Exact Mass | 257.946219 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DPUHrSpTGFo |
|---|---|
| Name | 3,5-Dichlorophenol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.946219224 u |
| Formula | C8H3Cl2F3O2 |
| InChI | InChI=1S/C8H3Cl2F3O2/c9-4-1-5(10)3-6(2-4)15-7(14)8(11,12)13/h1-3H |
| InChIKey | JAEYFRGCFZVNRY-UHFFFAOYSA-N |
| Molecular Weight | 259.011 g/mol |
| SMILES | C1=C(C=C(C=C1OC(C(F)(F)F)=O)Cl)Cl |