| SpectraBase Compound ID | Gp7csPLxhRD |
|---|---|
| InChI | InChI=1S/C16H21Cl3O6/c17-12-9-14(19)15(10-13(12)18)25-11-16(21)24-5-2-1-4-22-7-8-23-6-3-20/h9-10,20H,1-8,11H2 |
| InChIKey | JUKGKJRYJQHHOO-UHFFFAOYSA-N |
| Mol Weight | 415.7 g/mol |
| Molecular Formula | C16H21Cl3O6 |
| Exact Mass | 414.040371 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 | 9zfkek3ywRH |
|---|---|
| Name | 4-(2-(Hydroxyethoxy)ethoxy)butyl 2,4,5-trichlorophenoxyacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 414.040371490 u |
| Formula | C16H21Cl3O6 |
| InChI | InChI=1S/C16H21Cl3O6/c17-12-9-14(19)15(10-13(12)18)25-11-16(21)24-5-2-1-4-22-7-8-23-6-3-20/h9-10,20H,1-8,11H2 |
| InChIKey | JUKGKJRYJQHHOO-UHFFFAOYSA-N |
| Molecular Weight | 415.697 g/mol |
| SMILES | C1=C(C(Cl)=CC(=C1Cl)Cl)OCC(=O)OCCCCOCCOCCO |