| SpectraBase Compound ID | 6GsFjln1XHO |
|---|---|
| InChI | InChI=1S/C11H11I/c12-10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5,9H2 |
| InChIKey | FBBISCTWGCSUFC-UHFFFAOYSA-N |
| Mol Weight | 270.11 g/mol |
| Molecular Formula | C11H11I |
| Exact Mass | 269.990545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6wo4K7YxYEQ |
|---|---|
| Name | Benzene, (5-iodo-4-pentynyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.990545354 u |
| Formula | C11H11I |
| InChI | InChI=1S/C11H11I/c12-10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5,9H2 |
| InChIKey | FBBISCTWGCSUFC-UHFFFAOYSA-N |
| Molecular Weight | 270.113 g/mol |
| SMILES | C(#CCCCC1=CC=CC=C1)I |