| SpectraBase Compound ID | Dc1lqk5EYGF |
|---|---|
| InChI | InChI=1S/C5H7ClO2/c1-3-5(6)8-4(2)7/h3H,1-2H3/b5-3+ |
| InChIKey | SKNKDOZQCXIMKW-HWKANZROSA-N |
| Mol Weight | 134.56 g/mol |
| Molecular Formula | C5H7ClO2 |
| Exact Mass | 134.013457 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HybRrUDWybB |
|---|---|
| Name | 1-Chloro-1-propenylacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 134.013457163 u |
| Formula | C5H7ClO2 |
| InChI | InChI=1S/C5H7ClO2/c1-3-5(6)8-4(2)7/h3H,1-2H3/b5-3+ |
| InChIKey | SKNKDOZQCXIMKW-HWKANZROSA-N |
| Molecular Weight | 134.562 g/mol |
| SMILES | C(O\C(=C\C)Cl)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909859 |