| SpectraBase Compound ID | 3dqef47qmv7 |
|---|---|
| InChI | InChI=1S/C7H4ClIO/c8-6-3-1-2-5(4-10)7(6)9/h1-4H |
| InChIKey | QCASBRFHVKFMIE-UHFFFAOYSA-N |
| Mol Weight | 266.47 g/mol |
| Molecular Formula | C7H4ClIO |
| Exact Mass | 265.899537 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1AfvSrWZDvp |
|---|---|
| Name | 3-Chloro-2-iodobenzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.899537448 u |
| Formula | C7H4ClIO |
| InChI | InChI=1S/C7H4ClIO/c8-6-3-1-2-5(4-10)7(6)9/h1-4H |
| InChIKey | QCASBRFHVKFMIE-UHFFFAOYSA-N |
| Molecular Weight | 266.465 g/mol |
| SMILES | C(C=1C(=C(C=CC1)Cl)I)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.924528 |