| SpectraBase Compound ID | AZfs5kqmSAr |
|---|---|
| InChI | InChI=1S/C10H4Cl3F5O2/c11-4-1-6(12)5(7(13)2-4)3-20-8(19)9(14,15)10(16,17)18/h1-2H,3H2 |
| InChIKey | NQCRVLOBLOAURX-UHFFFAOYSA-N |
| Mol Weight | 357.49 g/mol |
| Molecular Formula | C10H4Cl3F5O2 |
| Exact Mass | 355.919703 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7eGWMPCzdvP |
|---|---|
| Name | 2,4,6-Trichlorobenzyl alcohol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 355.919703282 u |
| Formula | C10H4Cl3F5O2 |
| InChI | InChI=1S/C10H4Cl3F5O2/c11-4-1-6(12)5(7(13)2-4)3-20-8(19)9(14,15)10(16,17)18/h1-2H,3H2 |
| InChIKey | NQCRVLOBLOAURX-UHFFFAOYSA-N |
| Molecular Weight | 357.491 g/mol |
| SMILES | C1(=C(C=C(C=C1Cl)Cl)Cl)COC(C(C(F)(F)F)(F)F)=O |