| SpectraBase Compound ID | 6Q9OlgR6kR5 |
|---|---|
| InChI | InChI=1S/C14H20INO/c1-2-3-4-5-8-11-16-14(17)12-9-6-7-10-13(12)15/h6-7,9-10H,2-5,8,11H2,1H3,(H,16,17) |
| InChIKey | DGGJUBDHDVMZIH-UHFFFAOYSA-N |
| Mol Weight | 345.22 g/mol |
| Molecular Formula | C14H20INO |
| Exact Mass | 345.058959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4cag6auXFdW |
|---|---|
| Name | N-Heptyl-2-iodo-benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 345.058959267 u |
| Formula | C14H20INO |
| InChI | InChI=1S/C14H20INO/c1-2-3-4-5-8-11-16-14(17)12-9-6-7-10-13(12)15/h6-7,9-10H,2-5,8,11H2,1H3,(H,16,17) |
| InChIKey | DGGJUBDHDVMZIH-UHFFFAOYSA-N |
| Molecular Weight | 345.224 g/mol |
| SMILES | C1(=C(C=CC=C1)I)C(NCCCCCCC)=O |