| SpectraBase Compound ID | IAIVLS6qWfe |
|---|---|
| InChI | InChI=1S/C12H21IO2/c1-3-15-12(14)11(2)9-7-5-4-6-8-10-13/h2-10H2,1H3 |
| InChIKey | QGGDHWIHNLMSFY-UHFFFAOYSA-N |
| Mol Weight | 324.2 g/mol |
| Molecular Formula | C12H21IO2 |
| Exact Mass | 324.058625 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FHpcvAXAkiy |
|---|---|
| Name | Ethyl (7-iodoheptyl)acrylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.058624914 u |
| Formula | C12H21IO2 |
| InChI | InChI=1S/C12H21IO2/c1-3-15-12(14)11(2)9-7-5-4-6-8-10-13/h2-10H2,1H3 |
| InChIKey | QGGDHWIHNLMSFY-UHFFFAOYSA-N |
| Molecular Weight | 324.202 g/mol |
| SMILES | C(C(=C)CCCCCCCI)(=O)OCC |