| SpectraBase Compound ID | 8f4eZhRCQcs |
|---|---|
| InChI | InChI=1S/C9H10Cl2/c10-6-5-8-3-1-2-4-9(8)7-11/h1-4H,5-7H2 |
| InChIKey | WQHDLYRCIZJWTB-UHFFFAOYSA-N |
| Mol Weight | 189.08 g/mol |
| Molecular Formula | C9H10Cl2 |
| Exact Mass | 188.015956 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7nkLdZ2d1X1 |
|---|---|
| Name | Benzene, (2-chloroethyl)(chloromethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.015955722 u |
| Formula | C9H10Cl2 |
| InChI | InChI=1S/C9H10Cl2/c10-6-5-8-3-1-2-4-9(8)7-11/h1-4H,5-7H2 |
| InChIKey | WQHDLYRCIZJWTB-UHFFFAOYSA-N |
| Molecular Weight | 189.085 g/mol |
| SMILES | C=1(C(CCCl)=CC=CC1)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.890092 |