| SpectraBase Compound ID | JXmrKDROwSR |
|---|---|
| InChI | InChI=1S/C10H12Cl2O/c1-10(2,3)6-4-7(11)9(13)8(12)5-6/h4-5,13H,1-3H3 |
| InChIKey | RETRALMQVUXTPQ-UHFFFAOYSA-N |
| Mol Weight | 219.11 g/mol |
| Molecular Formula | C10H12Cl2O |
| Exact Mass | 218.02652 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D0jPMUIGRS2 |
|---|---|
| Name | Phenol, 2,6-dichloro-4-(1,1-dimethylethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.026520405 u |
| Formula | C10H12Cl2O |
| InChI | InChI=1S/C10H12Cl2O/c1-10(2,3)6-4-7(11)9(13)8(12)5-6/h4-5,13H,1-3H3 |
| InChIKey | RETRALMQVUXTPQ-UHFFFAOYSA-N |
| Molecular Weight | 219.111 g/mol |
| SMILES | OC1=C(C=C(C=C1Cl)C(C)(C)C)Cl |