| SpectraBase Compound ID | JWCdphbu47z |
|---|---|
| InChI | InChI=1S/C8H8Cl2O/c9-5-6-11-8-3-1-7(10)2-4-8/h1-4H,5-6H2 |
| InChIKey | DFJCCNZMGVNBKQ-UHFFFAOYSA-N |
| Mol Weight | 191.06 g/mol |
| Molecular Formula | C8H8Cl2O |
| Exact Mass | 189.99522 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EwGl9PKTjsm |
|---|---|
| Name | Benzene, 1-chloro-4-(2-chloroethoxy)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.995220277 u |
| Formula | C8H8Cl2O |
| InChI | InChI=1S/C8H8Cl2O/c9-5-6-11-8-3-1-7(10)2-4-8/h1-4H,5-6H2 |
| InChIKey | DFJCCNZMGVNBKQ-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC(=C1)Cl)OCCCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923805 |