| SpectraBase Compound ID | GVGfE8F8S2i |
|---|---|
| InChI | InChI=1S/C13H18INO/c1-12(16)15(11-7-3-6-10-14)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3 |
| InChIKey | FVWXVSZYUZCCCC-UHFFFAOYSA-N |
| Mol Weight | 331.2 g/mol |
| Molecular Formula | C13H18INO |
| Exact Mass | 331.043309 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Xj24O1R79j |
|---|---|
| Name | N-(5-Iodopentyl)-N-phenylacetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.043309203 u |
| Formula | C13H18INO |
| InChI | InChI=1S/C13H18INO/c1-12(16)15(11-7-3-6-10-14)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3 |
| InChIKey | FVWXVSZYUZCCCC-UHFFFAOYSA-N |
| Molecular Weight | 331.197 g/mol |
| SMILES | C(N(C=1C=CC=CC1)CCCCCI)(=O)C |