| SpectraBase Compound ID | 8v8t7Pt1HHd |
|---|---|
| InChI | InChI=1S/C21H45O4P/c1-5-8-11-12-13-14-17-24-26(22,19-10-7-3)25-20-21(15-9-6-2)16-18-23-4/h21H,5-20H2,1-4H3 |
| InChIKey | NASOJVOQNDEESF-UHFFFAOYSA-N |
| Mol Weight | 392.6 g/mol |
| Molecular Formula | C21H45O4P |
| Exact Mass | 392.305547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2QvBdBLWFn3 |
|---|---|
| Name | Butylphosphonic acid, 2-(2-methoxyethyl)hexyl octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.305546923 u |
| Formula | C21H45O4P |
| InChI | InChI=1S/C21H45O4P/c1-5-8-11-12-13-14-17-24-26(22,19-10-7-3)25-20-21(15-9-6-2)16-18-23-4/h21H,5-20H2,1-4H3 |
| InChIKey | NASOJVOQNDEESF-UHFFFAOYSA-N |
| Molecular Weight | 392.561 g/mol |
| SMILES | C(CCCCCCOP(OCC(CCCC)CCOC)(CCCC)=O)C |