| SpectraBase Compound ID | LoARAPaJwhU |
|---|---|
| InChI | InChI=1S/C8H14Cl2O/c1-2-3-4-5-6-8(9,10)7-11/h7H,2-6H2,1H3 |
| InChIKey | TUVHNFBPILFQME-UHFFFAOYSA-N |
| Mol Weight | 197.1 g/mol |
| Molecular Formula | C8H14Cl2O |
| Exact Mass | 196.04217 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9JDcLM6XCFH |
|---|---|
| Name | 2,2-Dichlorooctanal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.042170470 u |
| Formula | C8H14Cl2O |
| InChI | InChI=1S/C8H14Cl2O/c1-2-3-4-5-6-8(9,10)7-11/h7H,2-6H2,1H3 |
| InChIKey | TUVHNFBPILFQME-UHFFFAOYSA-N |
| Molecular Weight | 197.105 g/mol |
| SMILES | C(C(CCCCCC)(Cl)Cl)=O |