| SpectraBase Compound ID | 1WRCfW4w8QX |
|---|---|
| InChI | InChI=1S/C12H17ClO/c1-3-10(2)14-9-8-11-4-6-12(13)7-5-11/h4-7,10H,3,8-9H2,1-2H3 |
| InChIKey | NWJUQFBCNLYDJD-UHFFFAOYSA-N |
| Mol Weight | 212.72 g/mol |
| Molecular Formula | C12H17ClO |
| Exact Mass | 212.096793 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JA4IiESae7s |
|---|---|
| Name | 4-Chlorophenethyl alcohol, 1-methylpropyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.096792866 u |
| Formula | C12H17ClO |
| InChI | InChI=1S/C12H17ClO/c1-3-10(2)14-9-8-11-4-6-12(13)7-5-11/h4-7,10H,3,8-9H2,1-2H3 |
| InChIKey | NWJUQFBCNLYDJD-UHFFFAOYSA-N |
| Molecular Weight | 212.720 g/mol |
| SMILES | C1=CC(=CC=C1CCOC(CC)C)Cl |