| SpectraBase Compound ID | B80PUzRZkYR |
|---|---|
| InChI | InChI=1S/C12H14Cl2O2/c1-3-8(4-2)12(15)16-11-6-5-9(13)7-10(11)14/h5-8H,3-4H2,1-2H3 |
| InChIKey | YQVYHHSVKSEDBT-UHFFFAOYSA-N |
| Mol Weight | 261.15 g/mol |
| Molecular Formula | C12H14Cl2O2 |
| Exact Mass | 260.037085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 22ZJIIcZV3g |
|---|---|
| Name | 2-Ethylbutyric acid, 2,4-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.037085089 u |
| Formula | C12H14Cl2O2 |
| InChI | InChI=1S/C12H14Cl2O2/c1-3-8(4-2)12(15)16-11-6-5-9(13)7-10(11)14/h5-8H,3-4H2,1-2H3 |
| InChIKey | YQVYHHSVKSEDBT-UHFFFAOYSA-N |
| Molecular Weight | 261.148 g/mol |
| SMILES | C(=O)(OC1=CC=C(C=C1Cl)Cl)C(CC)CC |