| SpectraBase Compound ID | 5amWr3Gkjhe |
|---|---|
| InChI | InChI=1S/C10H5Cl2F5O2/c1-4-2-5(11)7(6(12)3-4)19-8(18)9(13,14)10(15,16)17/h2-3H,1H3 |
| InChIKey | SGXHCBCDOSXYMW-UHFFFAOYSA-N |
| Mol Weight | 323.05 g/mol |
| Molecular Formula | C10H5Cl2F5O2 |
| Exact Mass | 321.958676 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1X7vBwIuvSG |
|---|---|
| Name | 2,6-Dichloro-4-methylphenol, o-pentafluoropropionyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 321.958675614 u |
| Formula | C10H5Cl2F5O2 |
| InChI | InChI=1S/C10H5Cl2F5O2/c1-4-2-5(11)7(6(12)3-4)19-8(18)9(13,14)10(15,16)17/h2-3H,1H3 |
| InChIKey | SGXHCBCDOSXYMW-UHFFFAOYSA-N |
| Molecular Weight | 323.046 g/mol |
| SMILES | C1(OC(C(C(F)(F)F)(F)F)=O)=C(Cl)C=C(C=C1Cl)C |