| SpectraBase Compound ID | Axe9AQGCvB2 |
|---|---|
| InChI | InChI=1S/C10H13IO/c1-2-6-12-8-9-4-3-5-10(11)7-9/h3-5,7H,2,6,8H2,1H3 |
| InChIKey | XDCWMGLXKFLLQN-UHFFFAOYSA-N |
| Mol Weight | 276.12 g/mol |
| Molecular Formula | C10H13IO |
| Exact Mass | 276.00111 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7tmPRQ188Pg |
|---|---|
| Name | (3-Iodophenyl) methanol, N-propyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.001110038 u |
| Formula | C10H13IO |
| InChI | InChI=1S/C10H13IO/c1-2-6-12-8-9-4-3-5-10(11)7-9/h3-5,7H,2,6,8H2,1H3 |
| InChIKey | XDCWMGLXKFLLQN-UHFFFAOYSA-N |
| Molecular Weight | 276.117 g/mol |
| SMILES | C1(=CC(=CC=C1)I)COCCC |