| SpectraBase Compound ID | 3ZzbtCLTOc5 |
|---|---|
| InChI | InChI=1S/C5H5ClO2/c1-2-3-4-8-5(6)7/h4H2,1H3 |
| InChIKey | MFKKPMUEGDJJSL-UHFFFAOYSA-N |
| Mol Weight | 132.55 g/mol |
| Molecular Formula | C5H5ClO2 |
| Exact Mass | 131.997807 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H1wj3oSfhu2 |
|---|---|
| Name | 2-Butyn-1-yl chloroformate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 131.997807099 u |
| Formula | C5H5ClO2 |
| InChI | InChI=1S/C5H5ClO2/c1-2-3-4-8-5(6)7/h4H2,1H3 |
| InChIKey | MFKKPMUEGDJJSL-UHFFFAOYSA-N |
| SMILES | C(Cl)(OCC#CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.932172 |