| SpectraBase Compound ID | EC4IhoO1VOo |
|---|---|
| InChI | InChI=1S/C8H14Cl2O2/c1-3-4-5-6-12-7(11)8(2,9)10/h3-6H2,1-2H3 |
| InChIKey | ZCPOSLAFHCNHBE-UHFFFAOYSA-N |
| Mol Weight | 213.1 g/mol |
| Molecular Formula | C8H14Cl2O2 |
| Exact Mass | 212.037085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Rw1nfXAph9 |
|---|---|
| Name | Propionic acid, 2,2-dichloro-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.037085089 u |
| Formula | C8H14Cl2O2 |
| InChI | InChI=1S/C8H14Cl2O2/c1-3-4-5-6-12-7(11)8(2,9)10/h3-6H2,1-2H3 |
| InChIKey | ZCPOSLAFHCNHBE-UHFFFAOYSA-N |
| Molecular Weight | 213.104 g/mol |
| SMILES | C(OCCCCC)(C(C)(Cl)Cl)=O |