| SpectraBase Compound ID | 1nx1T1Er5YE |
|---|---|
| InChI | InChI=1S/C16H20Cl2O4/c1-2-3-4-5-6-11-14(19)21-12-9-7-8-10-13(12)22-16(20)15(17)18/h7-10,15H,2-6,11H2,1H3 |
| InChIKey | HGZFHFXXBCCEMZ-UHFFFAOYSA-N |
| Mol Weight | 347.24 g/mol |
| Molecular Formula | C16H20Cl2O4 |
| Exact Mass | 346.073865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9o8gZb8p16 |
|---|---|
| Name | 1,2-Benzenediol, o-(dichloroacetyl)-o'-(octanoyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.073864520 u |
| Formula | C16H20Cl2O4 |
| InChI | InChI=1S/C16H20Cl2O4/c1-2-3-4-5-6-11-14(19)21-12-9-7-8-10-13(12)22-16(20)15(17)18/h7-10,15H,2-6,11H2,1H3 |
| InChIKey | HGZFHFXXBCCEMZ-UHFFFAOYSA-N |
| Molecular Weight | 347.238 g/mol |
| SMILES | C1(=CC=CC=C1OC(=O)CCCCCCC)OC(=O)C(Cl)Cl |