| SpectraBase Compound ID | 9Ws658kYrZB |
|---|---|
| InChI | InChI=1S/C20H43O4P/c1-5-8-11-12-13-16-23-25(21,18-10-7-3)24-19-20(14-9-6-2)15-17-22-4/h20H,5-19H2,1-4H3 |
| InChIKey | IJZQOXBKPFWJBI-UHFFFAOYSA-N |
| Mol Weight | 378.5 g/mol |
| Molecular Formula | C20H43O4P |
| Exact Mass | 378.289897 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5MT16ZXaNuK |
|---|---|
| Name | Butylphosphonic acid, heptyl 2-(2-methoxyethyl)hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 378.289896859 u |
| Formula | C20H43O4P |
| InChI | InChI=1S/C20H43O4P/c1-5-8-11-12-13-16-23-25(21,18-10-7-3)24-19-20(14-9-6-2)15-17-22-4/h20H,5-19H2,1-4H3 |
| InChIKey | IJZQOXBKPFWJBI-UHFFFAOYSA-N |
| Molecular Weight | 378.534 g/mol |
| SMILES | C(OP(CCCC)(OCCCCCCC)=O)C(CCCC)CCOC |