| SpectraBase Compound ID | BS0hd9sXpM9 |
|---|---|
| InChI | InChI=1S/C8H15IO/c1-2-3-5-8(10)6-4-7-9/h2-7H2,1H3 |
| InChIKey | JGCFWEQOFRNBGW-UHFFFAOYSA-N |
| Mol Weight | 254.11 g/mol |
| Molecular Formula | C8H15IO |
| Exact Mass | 254.01676 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1KemM5bBcwI |
|---|---|
| Name | 1-Iodo-4-octanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.016760102 u |
| Formula | C8H15IO |
| InChI | InChI=1S/C8H15IO/c1-2-3-5-8(10)6-4-7-9/h2-7H2,1H3 |
| InChIKey | JGCFWEQOFRNBGW-UHFFFAOYSA-N |
| Molecular Weight | 254.111 g/mol |
| SMILES | C(=O)(CCCI)CCCC |