| SpectraBase Compound ID | 8XY52O83j1q |
|---|---|
| InChI | InChI=1S/C6H11ClO/c1-2-8-6-4-3-5-7/h3-4H,2,5-6H2,1H3/b4-3+ |
| InChIKey | ACPYSKZHRVGHQA-ONEGZZNKSA-N |
| Mol Weight | 134.61 g/mol |
| Molecular Formula | C6H11ClO |
| Exact Mass | 134.049843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LJkDULOuHSB |
|---|---|
| Name | 2-Butene, 1-chloro-4-ethoxy- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 134.049842673 u |
| Formula | C6H11ClO |
| InChI | InChI=1S/C6H11ClO/c1-2-8-6-4-3-5-7/h3-4H,2,5-6H2,1H3/b4-3+ |
| InChIKey | ACPYSKZHRVGHQA-ONEGZZNKSA-N |
| SMILES | C(\C=C\CCl)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952919 |