| SpectraBase Compound ID | 6gwJQSzbACu |
|---|---|
| InChI | InChI=1S/C36H75BO3/c1-4-7-10-13-16-19-22-25-28-31-34-38-37(39-35-32-29-26-23-20-17-14-11-8-5-2)40-36-33-30-27-24-21-18-15-12-9-6-3/h4-36H2,1-3H3 |
| InChIKey | HWJYGSDXNANCJM-UHFFFAOYSA-N |
| Mol Weight | 566.8 g/mol |
| Molecular Formula | C36H75BO3 |
| Exact Mass | 566.580926 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BBQ6xzBBmht |
|---|---|
| Name | Dodecyl borate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 566.580926442 u |
| Formula | C36H75BO3 |
| InChI | InChI=1S/C36H75BO3/c1-4-7-10-13-16-19-22-25-28-31-34-38-37(39-35-32-29-26-23-20-17-14-11-8-5-2)40-36-33-30-27-24-21-18-15-12-9-6-3/h4-36H2,1-3H3 |
| InChIKey | HWJYGSDXNANCJM-UHFFFAOYSA-N |
| Molecular Weight | 566.803 g/mol |
| SMILES | C(OB(OCCCCCCCCCCCC)OCCCCCCCCCCCC)CCCCCCCCCCC |