| SpectraBase Compound ID | 4P8GVOZtC0O |
|---|---|
| InChI | InChI=1S/C14H13IO/c1-10(16)12-8-5-9-13(14(12)15)11-6-3-2-4-7-11/h2-10,16H,1H3/t10-/m0/s1 |
| InChIKey | HEUODEPRHKIZSG-JTQLQIEISA-N |
| Mol Weight | 324.16 g/mol |
| Molecular Formula | C14H13IO |
| Exact Mass | 324.00111 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IRT3qsAbtrX |
|---|---|
| Name | (1S)-1-(2-Iodanyl-3-phenyl-phenyl)ethanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.001110038 u |
| Formula | C14H13IO |
| InChI | InChI=1S/C14H13IO/c1-10(16)12-8-5-9-13(14(12)15)11-6-3-2-4-7-11/h2-10,16H,1H3/t10-/m0/s1 |
| InChIKey | HEUODEPRHKIZSG-JTQLQIEISA-N |
| Molecular Weight | 324.161 g/mol |
| SMILES | C1(=C([C@@](O)(C)[H])C=CC=C1C1=CC=CC=C1)I |