![bis[2-(2,4,5-Trichlorophenoxy)ethyl] ether](/api/spectrum/JhNHmTVPw69/structure.png?h=300&w=458 "bis[2-(2,4,5-Trichlorophenoxy)ethyl] ether")
| SpectraBase Compound ID | CvXsTBJHcxI |
|---|---|
| InChI | InChI=1S/C16H12Cl6O3/c17-9-5-13(21)15(7-11(9)19)24-3-1-23-2-4-25-16-8-12(20)10(18)6-14(16)22/h5-8H,1-4H2 |
| InChIKey | YJIMXWPDLWCNRW-UHFFFAOYSA-N |
| Mol Weight | 465.0 g/mol |
| Molecular Formula | C16H12Cl6O3 |
| Exact Mass | 461.89176 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JhNHmTVPw69 |
|---|---|
| Name | bis[2-(2,4,5-Trichlorophenoxy)ethyl] ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 461.891760443 u |
| Formula | C16H12Cl6O3 |
| InChI | InChI=1S/C16H12Cl6O3/c17-9-5-13(21)15(7-11(9)19)24-3-1-23-2-4-25-16-8-12(20)10(18)6-14(16)22/h5-8H,1-4H2 |
| InChIKey | YJIMXWPDLWCNRW-UHFFFAOYSA-N |
| Molecular Weight | 464.987 g/mol |
| SMILES | C1=C(C(=CC(=C1Cl)Cl)OCCOCCOC=1C=C(C(=CC1Cl)Cl)Cl)Cl |