| SpectraBase Compound ID | 9IMihVa1FFk |
|---|---|
| InChI | InChI=1S/C15H11Cl2NO5/c16-11-3-6-14(13(17)9-11)22-7-8-23-15(19)10-1-4-12(5-2-10)18(20)21/h1-6,9H,7-8H2 |
| InChIKey | SDWHXKDNHDQGGE-UHFFFAOYSA-N |
| Mol Weight | 356.16 g/mol |
| Molecular Formula | C15H11Cl2NO5 |
| Exact Mass | 355.001428 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6XgHhTxoxz9 |
|---|---|
| Name | 2-(2,4-Dichlorophenoxy)ethanol, p-nitrobenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 355.001427853 u |
| Formula | C15H11Cl2NO5 |
| InChI | InChI=1S/C15H11Cl2NO5/c16-11-3-6-14(13(17)9-11)22-7-8-23-15(19)10-1-4-12(5-2-10)18(20)21/h1-6,9H,7-8H2 |
| InChIKey | SDWHXKDNHDQGGE-UHFFFAOYSA-N |
| Molecular Weight | 356.161 g/mol |
| SMILES | C=1(Cl)C=C(Cl)C=CC1OCCOC(C1=CC=C(C=C1)N(=O)=O)=O |