| SpectraBase Compound ID | Ffg2wu9l134 |
|---|---|
| InChI | InChI=1S/C8H12Cl2O2/c1-3-11-8(12-4-2)6-5-7(9)10/h7-8H,3-4H2,1-2H3 |
| InChIKey | WDOBEBZCCNUCGL-UHFFFAOYSA-N |
| Mol Weight | 211.09 g/mol |
| Molecular Formula | C8H12Cl2O2 |
| Exact Mass | 210.021435 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H2Sfp5xRXDg |
|---|---|
| Name | 1,1-Dichloro-4,4-diethoxy-2-butyne |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.021435024 u |
| Formula | C8H12Cl2O2 |
| InChI | InChI=1S/C8H12Cl2O2/c1-3-11-8(12-4-2)6-5-7(9)10/h7-8H,3-4H2,1-2H3 |
| InChIKey | WDOBEBZCCNUCGL-UHFFFAOYSA-N |
| Molecular Weight | 211.088 g/mol |
| SMILES | C(#CC(Cl)Cl)C(OCC)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.971634 |