| SpectraBase Compound ID | K5BDihHUT2y |
|---|---|
| InChI | InChI=1S/C11H15I/c12-10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2 |
| InChIKey | QVQYOJLZAUEILK-UHFFFAOYSA-N |
| Mol Weight | 274.15 g/mol |
| Molecular Formula | C11H15I |
| Exact Mass | 274.021845 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | J96OCDDuLH0 |
|---|---|
| Name | Benzene, (5-iodopentyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.021845483 u |
| Formula | C11H15I |
| InChI | InChI=1S/C11H15I/c12-10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2 |
| InChIKey | QVQYOJLZAUEILK-UHFFFAOYSA-N |
| Molecular Weight | 274.145 g/mol |
| SMILES | C1=CC(CCCCCI)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.879661 |