| SpectraBase Compound ID | 7MdhaHUNlyH |
|---|---|
| InChI | InChI=1S/C10H17ClO2/c1-3-5-6-7-8-9(11)10(12)13-4-2/h8H,3-7H2,1-2H3/b9-8- |
| InChIKey | UNECCAQAGXJLCT-HJWRWDBZSA-N |
| Mol Weight | 204.7 g/mol |
| Molecular Formula | C10H17ClO2 |
| Exact Mass | 204.091707 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FainfXssC6e |
|---|---|
| Name | (Z)-Ethyl 2-chlorooct-2-enoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.091707485 u |
| Formula | C10H17ClO2 |
| InChI | InChI=1S/C10H17ClO2/c1-3-5-6-7-8-9(11)10(12)13-4-2/h8H,3-7H2,1-2H3/b9-8- |
| InChIKey | UNECCAQAGXJLCT-HJWRWDBZSA-N |
| Molecular Weight | 204.697 g/mol |
| SMILES | C(\C(=C\CCCCC)Cl)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97667 |