| SpectraBase Compound ID | 7gzF96eVEnp |
|---|---|
| InChI | InChI=1S/C9H9ClO/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6,11H,7H2/b2-1+ |
| InChIKey | HFMHVOCTLZMPRY-OWOJBTEDSA-N |
| Mol Weight | 168.62 g/mol |
| Molecular Formula | C9H9ClO |
| Exact Mass | 168.034193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2AGn0GYHW1q |
|---|---|
| Name | (E)-3-(4'-Chlorophenyl)pop-2-en-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.034192609 u |
| Formula | C9H9ClO |
| InChI | InChI=1S/C9H9ClO/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6,11H,7H2/b2-1+ |
| InChIKey | HFMHVOCTLZMPRY-OWOJBTEDSA-N |
| Molecular Weight | 168.623 g/mol |
| SMILES | C(\C=C\C=1C=CC(=CC1)Cl)O |