| SpectraBase Compound ID | 4cxwWVR8LCu |
|---|---|
| InChI | InChI=1S/C13H18INO2/c1-2-3-9-17-10-8-15-13(16)11-4-6-12(14)7-5-11/h4-7H,2-3,8-10H2,1H3,(H,15,16) |
| InChIKey | ZYFRHNSXLPSTTG-UHFFFAOYSA-N |
| Mol Weight | 347.2 g/mol |
| Molecular Formula | C13H18INO2 |
| Exact Mass | 347.038224 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5COOW4uOaSs |
|---|---|
| Name | Benzamide, 4-iodo-N-(2-butoxyethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.038223822 u |
| Formula | C13H18INO2 |
| InChI | InChI=1S/C13H18INO2/c1-2-3-9-17-10-8-15-13(16)11-4-6-12(14)7-5-11/h4-7H,2-3,8-10H2,1H3,(H,15,16) |
| InChIKey | ZYFRHNSXLPSTTG-UHFFFAOYSA-N |
| Molecular Weight | 347.196 g/mol |
| SMILES | C(C1=CC=C(C=C1)I)(=O)NCCOCCCC |