| SpectraBase Compound ID | JYx9A56uslK |
|---|---|
| InChI | InChI=1S/C16H35O4P/c1-5-7-9-10-12-19-21(17,14-8-6-2)20-15-16(3)11-13-18-4/h16H,5-15H2,1-4H3 |
| InChIKey | QKHKAUSQMBHCQY-UHFFFAOYSA-N |
| Mol Weight | 322.4 g/mol |
| Molecular Formula | C16H35O4P |
| Exact Mass | 322.227297 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KJlKSWdwcSk |
|---|---|
| Name | Butylphosphonic acid, hexyl 4-methoxy-2-methylbutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.227296601 u |
| Formula | C16H35O4P |
| InChI | InChI=1S/C16H35O4P/c1-5-7-9-10-12-19-21(17,14-8-6-2)20-15-16(3)11-13-18-4/h16H,5-15H2,1-4H3 |
| InChIKey | QKHKAUSQMBHCQY-UHFFFAOYSA-N |
| Molecular Weight | 322.426 g/mol |
| SMILES | C(COP(CCCC)(OCCCCCC)=O)(CCOC)C |