| SpectraBase Compound ID | JshBo9j5ElF |
|---|---|
| InChI | InChI=1S/C11H13Cl3O/c1-2-3-4-5-15-11-7-9(13)8(12)6-10(11)14/h6-7H,2-5H2,1H3 |
| InChIKey | GGGAOBYRQNIPBO-UHFFFAOYSA-N |
| Mol Weight | 267.58 g/mol |
| Molecular Formula | C11H13Cl3O |
| Exact Mass | 266.003198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Vle2ZQaIYb |
|---|---|
| Name | 2,4,5-Trichlorophenol, N-pentyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.003198138 u |
| Formula | C11H13Cl3O |
| InChI | InChI=1S/C11H13Cl3O/c1-2-3-4-5-15-11-7-9(13)8(12)6-10(11)14/h6-7H,2-5H2,1H3 |
| InChIKey | GGGAOBYRQNIPBO-UHFFFAOYSA-N |
| Molecular Weight | 267.583 g/mol |
| SMILES | C1(=CC(=C(C=C1OCCCCC)Cl)Cl)Cl |