| SpectraBase Compound ID | 3qButtEInIA |
|---|---|
| InChI | InChI=1S/C15H20INO/c16-13-7-9-14(10-8-13)17-15(18)11-6-12-4-2-1-3-5-12/h7-10,12H,1-6,11H2,(H,17,18) |
| InChIKey | YDNRKWKMLSURJH-UHFFFAOYSA-N |
| Mol Weight | 357.24 g/mol |
| Molecular Formula | C15H20INO |
| Exact Mass | 357.058959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DUsuFunbWhG |
|---|---|
| Name | Cyclohexanepropanamide, N-(4-iodophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.058959267 u |
| Formula | C15H20INO |
| InChI | InChI=1S/C15H20INO/c16-13-7-9-14(10-8-13)17-15(18)11-6-12-4-2-1-3-5-12/h7-10,12H,1-6,11H2,(H,17,18) |
| InChIKey | YDNRKWKMLSURJH-UHFFFAOYSA-N |
| Molecular Weight | 357.235 g/mol |
| SMILES | N(C(=O)CCC1CCCCC1)C1=CC=C(C=C1)I |