| SpectraBase Compound ID | 9ps3D8ElxOw |
|---|---|
| InChI | InChI=1S/C10H11IO2/c1-8(12)13-10(7-11)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3 |
| InChIKey | WOVUFMATQUDANP-UHFFFAOYSA-N |
| Mol Weight | 290.1 g/mol |
| Molecular Formula | C10H11IO2 |
| Exact Mass | 289.980375 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HE26DdkmC6D |
|---|---|
| Name | 2-Iodo-1-phenylethyl acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.980374592 u |
| Formula | C10H11IO2 |
| InChI | InChI=1S/C10H11IO2/c1-8(12)13-10(7-11)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3 |
| InChIKey | WOVUFMATQUDANP-UHFFFAOYSA-N |
| Molecular Weight | 290.100 g/mol |
| SMILES | C(OC(C1=CC=CC=C1)CI)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936489 |