| SpectraBase Compound ID | BG8qiQsCeCa |
|---|---|
| InChI | InChI=1S/C5H9IO2/c6-3-1-2-4-8-5-7/h5H,1-4H2 |
| InChIKey | JKEKQUBSUPBTCG-UHFFFAOYSA-N |
| Mol Weight | 228.03 g/mol |
| Molecular Formula | C5H9IO2 |
| Exact Mass | 227.964725 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CR7bIQjaPYj |
|---|---|
| Name | 4-Iodanylbutyl methanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.964724528 u |
| Formula | C5H9IO2 |
| InChI | InChI=1S/C5H9IO2/c6-3-1-2-4-8-5-7/h5H,1-4H2 |
| InChIKey | JKEKQUBSUPBTCG-UHFFFAOYSA-N |
| Molecular Weight | 228.029 g/mol |
| SMILES | C(=O)OCCCCI |