| SpectraBase Compound ID | 5UqhjnjWET6 |
|---|---|
| InChI | InChI=1S/C17H16Cl2O2/c1-17(2,3)16(20)21-13-7-4-11(5-8-13)14-10-12(18)6-9-15(14)19/h4-10H,1-3H3 |
| InChIKey | SZXNETNMOQRWQN-UHFFFAOYSA-N |
| Mol Weight | 323.22 g/mol |
| Molecular Formula | C17H16Cl2O2 |
| Exact Mass | 322.052735 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 50cgYmAT0tD |
|---|---|
| Name | 4-Hydroxy-2',5'-dichlorobiphenyl, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.052735153 u |
| Formula | C17H16Cl2O2 |
| InChI | InChI=1S/C17H16Cl2O2/c1-17(2,3)16(20)21-13-7-4-11(5-8-13)14-10-12(18)6-9-15(14)19/h4-10H,1-3H3 |
| InChIKey | SZXNETNMOQRWQN-UHFFFAOYSA-N |
| Molecular Weight | 323.219 g/mol |
| SMILES | C1(C2=C(C=CC(=C2)Cl)Cl)=CC=C(C=C1)OC(C(C)(C)C)=O |