| SpectraBase Compound ID | 8lViVekfG3S |
|---|---|
| InChI | InChI=1S/C21H45O4P/c1-5-7-9-10-11-12-13-14-15-17-24-26(22,19-8-6-2)25-20-21(3)16-18-23-4/h21H,5-20H2,1-4H3 |
| InChIKey | YHMZCJVTMOPQRP-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 | 638NvZ7ykFP |
|---|---|
| Name | Butylphosphonic acid, 4-methoxy-2-methylbutyl undecyl 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/c1-5-7-9-10-11-12-13-14-15-17-24-26(22,19-8-6-2)25-20-21(3)16-18-23-4/h21H,5-20H2,1-4H3 |
| InChIKey | YHMZCJVTMOPQRP-UHFFFAOYSA-N |
| Molecular Weight | 392.561 g/mol |
| SMILES | C(OP(CCCC)(=O)OCC(CCOC)C)CCCCCCCCCC |