| SpectraBase Compound ID | AfOZFYWUlEF |
|---|---|
| InChI | InChI=1S/C8H5Cl5/c9-5-3-1-2-4(7(10)11)6(5)8(12)13/h1-3,7-8H |
| InChIKey | RHXYDIOPWOGXRP-UHFFFAOYSA-N |
| Mol Weight | 278.4 g/mol |
| Molecular Formula | C8H5Cl5 |
| Exact Mass | 275.883389 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7RoAFi6zbEd |
|---|---|
| Name | bis-1,2-(Dichloromethyl)-3-chlorobenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.883388661 u |
| Formula | C8H5Cl5 |
| InChI | InChI=1S/C8H5Cl5/c9-5-3-1-2-4(7(10)11)6(5)8(12)13/h1-3,7-8H |
| InChIKey | RHXYDIOPWOGXRP-UHFFFAOYSA-N |
| Molecular Weight | 278.393 g/mol |
| SMILES | C1(=C(C(Cl)Cl)C=CC=C1Cl)C(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94939 |