| SpectraBase Compound ID | GNiQ9zRCIuD |
|---|---|
| InChI | InChI=1S/C8H17I/c1-3-4-5-6-7-8(2)9/h8H,3-7H2,1-2H3 |
| InChIKey | XFLOGTUFKZCFTK-UHFFFAOYSA-N |
| Mol Weight | 240.13 g/mol |
| Molecular Formula | C8H17I |
| Exact Mass | 240.037496 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EzjiAuZPSxO |
|---|---|
| Name | 2-Iodooctane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.037495547 u |
| Formula | C8H17I |
| InChI | InChI=1S/C8H17I/c1-3-4-5-6-7-8(2)9/h8H,3-7H2,1-2H3 |
| InChIKey | XFLOGTUFKZCFTK-UHFFFAOYSA-N |
| Molecular Weight | 240.128 g/mol |
| SMILES | CCCCCCC(C)I |