| SpectraBase Compound ID | 6bGnPuno1xX |
|---|---|
| InChI | InChI=1S/C15H11Cl3O4/c16-10-1-4-12(5-2-10)21-9-22-15(19)8-20-14-6-3-11(17)7-13(14)18/h1-7H,8-9H2 |
| InChIKey | RYZMUZOFQHFJHD-UHFFFAOYSA-N |
| Mol Weight | 361.61 g/mol |
| Molecular Formula | C15H11Cl3O4 |
| Exact Mass | 359.972292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4G91WuGUB1t |
|---|---|
| Name | (2,4-Dichlorophenoxy)acetic acid, (p-chlorophenoxy)methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 359.972291930 u |
| Formula | C15H11Cl3O4 |
| InChI | InChI=1S/C15H11Cl3O4/c16-10-1-4-12(5-2-10)21-9-22-15(19)8-20-14-6-3-11(17)7-13(14)18/h1-7H,8-9H2 |
| InChIKey | RYZMUZOFQHFJHD-UHFFFAOYSA-N |
| Molecular Weight | 361.608 g/mol |
| SMILES | C1=C(C(=CC=C1Cl)OCC(OCOC=1C=CC(=CC1)Cl)=O)Cl |