| SpectraBase Compound ID | 5WWfp0PZk4T |
|---|---|
| InChI | InChI=1S/C15H20Cl2O2/c1-2-3-4-5-6-7-8-15(18)19-12-9-10-13(16)14(17)11-12/h9-11H,2-8H2,1H3 |
| InChIKey | GLRDUADSTVKNMV-UHFFFAOYSA-N |
| Mol Weight | 303.23 g/mol |
| Molecular Formula | C15H20Cl2O2 |
| Exact Mass | 302.084035 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AJSXTPyK1PH |
|---|---|
| Name | Nonanoic acid, 3,4-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.084035282 u |
| Formula | C15H20Cl2O2 |
| InChI | InChI=1S/C15H20Cl2O2/c1-2-3-4-5-6-7-8-15(18)19-12-9-10-13(16)14(17)11-12/h9-11H,2-8H2,1H3 |
| InChIKey | GLRDUADSTVKNMV-UHFFFAOYSA-N |
| Molecular Weight | 303.229 g/mol |
| SMILES | C(CC)CCCCCC(=O)OC1=CC(=C(C=C1)Cl)Cl |