| SpectraBase Compound ID | 4tDbp9g9weE |
|---|---|
| InChI | InChI=1S/C17H17ClO2/c1-17(2,3)16(19)20-15-10-6-13(7-11-15)12-4-8-14(18)9-5-12/h4-11H,1-3H3 |
| InChIKey | SFHCKIOXHKVNSL-UHFFFAOYSA-N |
| Mol Weight | 288.77 g/mol |
| Molecular Formula | C17H17ClO2 |
| Exact Mass | 288.091707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C90oqh5AUqV |
|---|---|
| Name | 4-Hydroxy-4'-chlorobiphenyl, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.091707485 u |
| Formula | C17H17ClO2 |
| InChI | InChI=1S/C17H17ClO2/c1-17(2,3)16(19)20-15-10-6-13(7-11-15)12-4-8-14(18)9-5-12/h4-11H,1-3H3 |
| InChIKey | SFHCKIOXHKVNSL-UHFFFAOYSA-N |
| SMILES | C1(C2=CC=C(C=C2)Cl)=CC=C(C=C1)OC(C(C)(C)C)=O |