| SpectraBase Compound ID | 8KeLWSOJBVc |
|---|---|
| InChI | InChI=1S/C10H12Cl2O/c1-7(2)6-13-10-5-8(11)3-4-9(10)12/h3-5,7H,6H2,1-2H3 |
| InChIKey | NTMVADKPHVUFKK-UHFFFAOYSA-N |
| Mol Weight | 219.11 g/mol |
| Molecular Formula | C10H12Cl2O |
| Exact Mass | 218.02652 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Iqyf0JAGz1S |
|---|---|
| Name | 2,5-Dichlorophenol, 2-methylpropyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.026520405 u |
| Formula | C10H12Cl2O |
| InChI | InChI=1S/C10H12Cl2O/c1-7(2)6-13-10-5-8(11)3-4-9(10)12/h3-5,7H,6H2,1-2H3 |
| InChIKey | NTMVADKPHVUFKK-UHFFFAOYSA-N |
| Molecular Weight | 219.111 g/mol |
| SMILES | C1(=CC=C(C=C1OCC(C)C)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941029 |