| SpectraBase Compound ID | 83xojofHFoM |
|---|---|
| InChI | InChI=1S/C12H21IO2/c13-9-5-2-1-3-6-10-14-12-8-4-7-11-15-12/h5,9,12H,1-4,6-8,10-11H2/b9-5+ |
| InChIKey | LBHNSKVNDDQURC-WEVVVXLNSA-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 | 7UJ2BQbMEEe |
|---|---|
| Name | (E)-7-Iodo-1-(2-tetrahydropyranyloxy)-6-heptene |
| 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/c13-9-5-2-1-3-6-10-14-12-8-4-7-11-15-12/h5,9,12H,1-4,6-8,10-11H2/b9-5+ |
| InChIKey | LBHNSKVNDDQURC-WEVVVXLNSA-N |
| Molecular Weight | 324.202 g/mol |
| SMILES | C1(OCCCC1)OCCCCC\C=C\I |