| SpectraBase Compound ID | 2dtK9SXzWj9 |
|---|---|
| InChI | InChI=1S/C7H8IN/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,1H3 |
| InChIKey | IZVRDZGBMDYYQT-UHFFFAOYSA-N |
| Mol Weight | 233.05 g/mol |
| Molecular Formula | C7H8IN |
| Exact Mass | 232.970144 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4JdBtGr3IkU |
|---|---|
| Name | 4-Iodo-N-methylaniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.970144262 u |
| Formula | C7H8IN |
| InChI | InChI=1S/C7H8IN/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,1H3 |
| InChIKey | IZVRDZGBMDYYQT-UHFFFAOYSA-N |
| Molecular Weight | 233.052 g/mol |
| SMILES | C1(NC)=CC=C(C=C1)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.823206 |