| SpectraBase Compound ID | 1MYd3LyNsUe |
|---|---|
| InChI | InChI=1S/C12H13Cl3O/c13-9-6-11(15)12(7-10(9)14)16-8-4-2-1-3-5-8/h6-8H,1-5H2 |
| InChIKey | PVPGPRLXAYPWIL-UHFFFAOYSA-N |
| Mol Weight | 279.59 g/mol |
| Molecular Formula | C12H13Cl3O |
| Exact Mass | 278.003198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J0IeFT4b7TY |
|---|---|
| Name | 1,2,4-Trichloro-5-(cyclohexoxy)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.003198138 u |
| Formula | C12H13Cl3O |
| InChI | InChI=1S/C12H13Cl3O/c13-9-6-11(15)12(7-10(9)14)16-8-4-2-1-3-5-8/h6-8H,1-5H2 |
| InChIKey | PVPGPRLXAYPWIL-UHFFFAOYSA-N |
| SMILES | C1(=CC(Cl)=C(C=C1Cl)Cl)OC1CCCCC1 |