| SpectraBase Compound ID | CzNHidShGaN |
|---|---|
| InChI | InChI=1S/C14H25ClO2/c1-2-3-4-5-6-7-8-9-10-13-17-14(16)11-12-15/h2H,1,3-13H2 |
| InChIKey | NPXHEBIDHILZLN-UHFFFAOYSA-N |
| Mol Weight | 260.8 g/mol |
| Molecular Formula | C14H25ClO2 |
| Exact Mass | 260.154308 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8yGfnSHnVaG |
|---|---|
| Name | 3-Chloropropionic acid, 10-undecenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.154307743 u |
| Formula | C14H25ClO2 |
| InChI | InChI=1S/C14H25ClO2/c1-2-3-4-5-6-7-8-9-10-13-17-14(16)11-12-15/h2H,1,3-13H2 |
| InChIKey | NPXHEBIDHILZLN-UHFFFAOYSA-N |
| Molecular Weight | 260.805 g/mol |
| SMILES | C(Cl)CC(OCCCCCCCCCC=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951181 |