| SpectraBase Compound ID | 2dPAUlpQHjc |
|---|---|
| InChI | InChI=1S/C10H13IO/c1-2-7-12-8-9-5-3-4-6-10(9)11/h3-6H,2,7-8H2,1H3 |
| InChIKey | WKLBZCIYAZYVTD-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 | Dytd0OXw4Ot |
|---|---|
| Name | 2-Iodobenzyl alcohol, 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/c1-2-7-12-8-9-5-3-4-6-10(9)11/h3-6H,2,7-8H2,1H3 |
| InChIKey | WKLBZCIYAZYVTD-UHFFFAOYSA-N |
| Molecular Weight | 276.117 g/mol |
| SMILES | C1(=CC=CC=C1COCCC)I |