| SpectraBase Compound ID | 5dCmZ9Bk6LQ |
|---|---|
| InChI | InChI=1S/C12H23ClO/c1-2-3-4-5-6-7-8-9-10-12(13)11-14/h11-12H,2-10H2,1H3 |
| InChIKey | IPBDZMSRGQIGHA-UHFFFAOYSA-N |
| Mol Weight | 218.77 g/mol |
| Molecular Formula | C12H23ClO |
| Exact Mass | 218.143743 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HRKubY7ugKP |
|---|---|
| Name | 2-Chlorododecanal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.143743060 u |
| Formula | C12H23ClO |
| InChI | InChI=1S/C12H23ClO/c1-2-3-4-5-6-7-8-9-10-12(13)11-14/h11-12H,2-10H2,1H3 |
| InChIKey | IPBDZMSRGQIGHA-UHFFFAOYSA-N |
| Molecular Weight | 218.768 g/mol |
| SMILES | C(=O)C(Cl)CCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.897785 |