| SpectraBase Compound ID | BXdvEj8Uhud |
|---|---|
| InChI | InChI=1S/C10H9Cl5O/c1-4(2)3-16-10-8(14)6(12)5(11)7(13)9(10)15/h4H,3H2,1-2H3 |
| InChIKey | ZUDONOPHJYXGIT-UHFFFAOYSA-N |
| Mol Weight | 322.4 g/mol |
| Molecular Formula | C10H9Cl5O |
| Exact Mass | 319.909603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IIS71plreO6 |
|---|---|
| Name | Pentachlorophenol, 2-methylpropyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.909603409 u |
| Formula | C10H9Cl5O |
| InChI | InChI=1S/C10H9Cl5O/c1-4(2)3-16-10-8(14)6(12)5(11)7(13)9(10)15/h4H,3H2,1-2H3 |
| InChIKey | ZUDONOPHJYXGIT-UHFFFAOYSA-N |
| Molecular Weight | 322.446 g/mol |
| SMILES | C1(=C(C(=C(C(=C1OCC(C)C)Cl)Cl)Cl)Cl)Cl |