| SpectraBase Compound ID | 2KJtEoZ5bmP |
|---|---|
| InChI | InChI=1S/C10H9Cl3O3/c11-3-4-15-10(14)6-16-9-2-1-7(12)5-8(9)13/h1-2,5H,3-4,6H2 |
| InChIKey | GMYRFASSFLNTPN-UHFFFAOYSA-N |
| Mol Weight | 283.54 g/mol |
| Molecular Formula | C10H9Cl3O3 |
| Exact Mass | 281.961727 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 31vRfsqYOYG |
|---|---|
| Name | 2,4-Dichlorophenoxyacetic acid, 2-chloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.961727247 u |
| Formula | C10H9Cl3O3 |
| InChI | InChI=1S/C10H9Cl3O3/c11-3-4-15-10(14)6-16-9-2-1-7(12)5-8(9)13/h1-2,5H,3-4,6H2 |
| InChIKey | GMYRFASSFLNTPN-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC(=C1Cl)OCC(OCCCl)=O)Cl |