| SpectraBase Compound ID | JRZM58B0YFc |
|---|---|
| InChI | InChI=1S/C7H5Cl2F7O2/c8-1-3(9)2-18-4(17)5(10,11)6(12,13)7(14,15)16/h3H,1-2H2 |
| InChIKey | ZGQHOYDDKQCAMJ-UHFFFAOYSA-N |
| Mol Weight | 325.01 g/mol |
| Molecular Formula | C7H5Cl2F7O2 |
| Exact Mass | 323.955482 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4GYrWL9VsED |
|---|---|
| Name | 2,3-Dichloropropane-1-heptafluorobutyrate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.955481940 u |
| Formula | C7H5Cl2F7O2 |
| InChI | InChI=1S/C7H5Cl2F7O2/c8-1-3(9)2-18-4(17)5(10,11)6(12,13)7(14,15)16/h3H,1-2H2 |
| InChIKey | ZGQHOYDDKQCAMJ-UHFFFAOYSA-N |
| Molecular Weight | 325.010 g/mol |
| SMILES | C(C(C(OCC(Cl)CCl)=O)(F)F)(C(F)(F)F)(F)F |