| SpectraBase Compound ID | 2a1KFdlqmJz |
|---|---|
| InChI | InChI=1S/C16H35O3P/c1-4-7-10-12-14-18-20(17,16-9-6-3)19-15-13-11-8-5-2/h4-16H2,1-3H3 |
| InChIKey | TXBZSQHHLAYPHS-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C16H35O3P |
| Exact Mass | 306.232382 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8HjbHhS8WWo |
|---|---|
| Name | Butylphosphonic acid, dihexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.232381982 u |
| Formula | C16H35O3P |
| InChI | InChI=1S/C16H35O3P/c1-4-7-10-12-14-18-20(17,16-9-6-3)19-15-13-11-8-5-2/h4-16H2,1-3H3 |
| InChIKey | TXBZSQHHLAYPHS-UHFFFAOYSA-N |
| Molecular Weight | 306.427 g/mol |
| SMILES | C(OP(CCCC)(OCCCCCC)=O)CCCCC |