| SpectraBase Compound ID | L4O1nGFdcsr |
|---|---|
| InChI | InChI=1S/C10H11IO/c1-3-8-5-4-6-9(7(2)12)10(8)11/h4-6H,3H2,1-2H3 |
| InChIKey | MMHIVETUXAMCLY-UHFFFAOYSA-N |
| Mol Weight | 274.1 g/mol |
| Molecular Formula | C10H11IO |
| Exact Mass | 273.98546 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ij3QEhFWXdD |
|---|---|
| Name | 1-(3-Ethyl-2-iodophenyl)ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.985459973 u |
| Formula | C10H11IO |
| InChI | InChI=1S/C10H11IO/c1-3-8-5-4-6-9(7(2)12)10(8)11/h4-6H,3H2,1-2H3 |
| InChIKey | MMHIVETUXAMCLY-UHFFFAOYSA-N |
| Molecular Weight | 274.101 g/mol |
| SMILES | C(=O)(C=1C=CC=C(C1I)CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.907934 |