| SpectraBase Compound ID | J3NY4dcOBBF |
|---|---|
| InChI | InChI=1S/C9H12INO/c10-8-3-1-7(2-4-8)5-9(11)6-12/h1-4,9,12H,5-6,11H2 |
| InChIKey | MPCOBLKNQSOAGC-UHFFFAOYSA-N |
| Mol Weight | 277.11 g/mol |
| Molecular Formula | C9H12INO |
| Exact Mass | 276.996359 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bkp946ondND |
|---|---|
| Name | 2-Amino-3-(4-iodophenyl)propan-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.996359009 u |
| Formula | C9H12INO |
| InChI | InChI=1S/C9H12INO/c10-8-3-1-7(2-4-8)5-9(11)6-12/h1-4,9,12H,5-6,11H2 |
| InChIKey | MPCOBLKNQSOAGC-UHFFFAOYSA-N |
| Molecular Weight | 277.105 g/mol |
| SMILES | C1(I)=CC=C(C=C1)CC(N)CO |