| SpectraBase Compound ID | JpeyiyiV8vu |
|---|---|
| InChI | InChI=1S/C8H7ClO/c1-6-3-2-4-8(9)7(6)5-10/h2-5H,1H3 |
| InChIKey | CCYFXIJPJFSTSU-UHFFFAOYSA-N |
| Mol Weight | 154.6 g/mol |
| Molecular Formula | C8H7ClO |
| Exact Mass | 154.018543 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6mjv9OqzLjE |
|---|---|
| Name | 2-Chloro-6-methylbenzadehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.018542544 u |
| Formula | C8H7ClO |
| InChI | InChI=1S/C8H7ClO/c1-6-3-2-4-8(9)7(6)5-10/h2-5H,1H3 |
| InChIKey | CCYFXIJPJFSTSU-UHFFFAOYSA-N |
| Molecular Weight | 154.596 g/mol |
| SMILES | C1(=C(C=CC=C1C)Cl)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.895461 |