| SpectraBase Compound ID | 5lUCeB4rdYo |
|---|---|
| InChI | InChI=1S/C14H9Cl2NO5/c15-11-2-1-3-12(16)14(11)21-8-13(18)22-10-6-4-9(5-7-10)17(19)20/h1-7H,8H2 |
| InChIKey | YGVZCUGTPCFIJD-UHFFFAOYSA-N |
| Mol Weight | 342.13 g/mol |
| Molecular Formula | C14H9Cl2NO5 |
| Exact Mass | 340.985778 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IWLs9BCfVZO |
|---|---|
| Name | 4-Nitrophenyl 2-(2,6-dichlorophenoxy)acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.985777789 u |
| Formula | C14H9Cl2NO5 |
| InChI | InChI=1S/C14H9Cl2NO5/c15-11-2-1-3-12(16)14(11)21-8-13(18)22-10-6-4-9(5-7-10)17(19)20/h1-7H,8H2 |
| InChIKey | YGVZCUGTPCFIJD-UHFFFAOYSA-N |
| Molecular Weight | 342.134 g/mol |
| SMILES | c1(N(=O)=O)ccc(OC(=O)COc2c(Cl)cccc2Cl)cc1 |