![4-Heptyl-2-phenyl[1,3,2]dioxaborolane](/api/spectrum/5DeuJ6C75Rz/structure.png?h=300&w=458 "4-Heptyl-2-phenyl[1,3,2]dioxaborolane")
| SpectraBase Compound ID | C1cATX3YkwG |
|---|---|
| InChI | InChI=1S/C15H23BO2/c1-2-3-4-5-9-12-15-13-17-16(18-15)14-10-7-6-8-11-14/h6-8,10-11,15H,2-5,9,12-13H2,1H3 |
| InChIKey | UCLXOACEHKFLIF-UHFFFAOYSA-N |
| Mol Weight | 246.2 g/mol |
| Molecular Formula | C15H23BO2 |
| Exact Mass | 246.17911 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5DeuJ6C75Rz |
|---|---|
| Name | 4-Heptyl-2-phenyl[1,3,2]dioxaborolane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.179110149 u |
| Formula | C15H23BO2 |
| InChI | InChI=1S/C15H23BO2/c1-2-3-4-5-9-12-15-13-17-16(18-15)14-10-7-6-8-11-14/h6-8,10-11,15H,2-5,9,12-13H2,1H3 |
| InChIKey | UCLXOACEHKFLIF-UHFFFAOYSA-N |
| Molecular Weight | 246.157 g/mol |
| SMILES | C1OB(C2=CC=CC=C2)OC1CCCCCCC |