| SpectraBase Compound ID | 8w5LAucWS8C |
|---|---|
| InChI | InChI=1S/C10H11IO/c1-8(12)2-3-9-4-6-10(11)7-5-9/h2-8,12H,1H3/b3-2+ |
| InChIKey | KDMBLVFJUYSZRS-NSCUHMNNSA-N |
| Mol Weight | 274.1 g/mol |
| Molecular Formula | C10H11IO |
| Exact Mass | 273.98546 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Z5h98O9VVt |
|---|---|
| Name | 4-(4-Iodophenyl)but-3-en-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.985459973 u |
| Formula | C10H11IO |
| InChI | InChI=1S/C10H11IO/c1-8(12)2-3-9-4-6-10(11)7-5-9/h2-8,12H,1H3/b3-2+ |
| InChIKey | KDMBLVFJUYSZRS-NSCUHMNNSA-N |
| Molecular Weight | 274.101 g/mol |
| SMILES | CC(\C=C\C=1C=CC(=CC1)I)O |