| SpectraBase Compound ID | 2feJPK4zm88 |
|---|---|
| InChI | InChI=1S/C20H39O3P/c1-2-3-18-24(21,22-16-14-19-10-6-4-7-11-19)23-17-15-20-12-8-5-9-13-20/h19-20H,2-18H2,1H3 |
| InChIKey | FDMKETFSTYJFKY-UHFFFAOYSA-N |
| Mol Weight | 358.5 g/mol |
| Molecular Formula | C20H39O3P |
| Exact Mass | 358.263682 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KQ7dRYAtMmr |
|---|---|
| Name | Butylphosphonic acid, di(2-cyclohexylethyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 358.263682111 u |
| Formula | C20H39O3P |
| InChI | InChI=1S/C20H39O3P/c1-2-3-18-24(21,22-16-14-19-10-6-4-7-11-19)23-17-15-20-12-8-5-9-13-20/h19-20H,2-18H2,1H3 |
| InChIKey | FDMKETFSTYJFKY-UHFFFAOYSA-N |
| Molecular Weight | 358.503 g/mol |
| SMILES | C1CCC(CC1)CCOP(OCCC1CCCCC1)(CCCC)=O |