| SpectraBase Compound ID | DR0LUa1U0qj |
|---|---|
| InChI | InChI=1S/C11H11I/c1-10(12)6-5-9-11-7-3-2-4-8-11/h2-8H,1,9H2/b6-5+ |
| InChIKey | NAAQSKQUKVBYGS-AATRIKPKSA-N |
| Mol Weight | 270.11 g/mol |
| Molecular Formula | C11H11I |
| Exact Mass | 269.990545 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3k7FBKH0gQX |
|---|---|
| Name | 2-Iodo-5-phenyl-1,3-pentadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.990545354 u |
| Formula | C11H11I |
| InChI | InChI=1S/C11H11I/c1-10(12)6-5-9-11-7-3-2-4-8-11/h2-8H,1,9H2/b6-5+ |
| InChIKey | NAAQSKQUKVBYGS-AATRIKPKSA-N |
| Molecular Weight | 270.113 g/mol |
| SMILES | C(\C=C\CC1=CC=CC=C1)(=C)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.92975 |