| SpectraBase Compound ID | 4txlkeKrmVl |
|---|---|
| InChI | InChI=1S/C9H4Cl3F3O2/c10-4-1-6(11)5(7(12)2-4)3-17-8(16)9(13,14)15/h1-2H,3H2 |
| InChIKey | RLCYNBQBWGKCBH-UHFFFAOYSA-N |
| Mol Weight | 307.48 g/mol |
| Molecular Formula | C9H4Cl3F3O2 |
| Exact Mass | 305.922897 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CiWxfSpLm0 |
|---|---|
| Name | 2,4,6-Trichlorobenzyl alcohol, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.922896956 u |
| Formula | C9H4Cl3F3O2 |
| InChI | InChI=1S/C9H4Cl3F3O2/c10-4-1-6(11)5(7(12)2-4)3-17-8(16)9(13,14)15/h1-2H,3H2 |
| InChIKey | RLCYNBQBWGKCBH-UHFFFAOYSA-N |
| Molecular Weight | 307.483 g/mol |
| SMILES | C1(=C(C=C(C=C1Cl)Cl)Cl)COC(C(F)(F)F)=O |