| SpectraBase Compound ID | DcxPtHL37tK |
|---|---|
| InChI | InChI=1S/C12H8Cl2/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8H |
| InChIKey | KTXUOWUHFLBZPW-UHFFFAOYSA-N |
| Mol Weight | 223.1 g/mol |
| Molecular Formula | C12H8Cl2 |
| Exact Mass | 222.000306 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ABuiMADrGpS |
|---|---|
| Name | 3,3'-Dichlorobiphenyl |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.000305658 u |
| Formula | C12H8Cl2 |
| InChI | InChI=1S/C12H8Cl2/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8H |
| InChIKey | KTXUOWUHFLBZPW-UHFFFAOYSA-N |
| Molecular Weight | 223.102 g/mol |
| SMILES | C1(Cl)=CC=CC(=C1)C1=CC(Cl)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.931617 |