| SpectraBase Compound ID | J5oqcgVcMIH |
|---|---|
| InChI | InChI=1S/C26H55O3P/c1-4-7-10-12-13-14-15-16-17-18-19-20-21-23-25-29-30(27,26-9-6-3)28-24-22-11-8-5-2/h4-26H2,1-3H3 |
| InChIKey | ZJKGUOXVMVECBJ-UHFFFAOYSA-N |
| Mol Weight | 446.7 g/mol |
| Molecular Formula | C26H55O3P |
| Exact Mass | 446.388883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | hY9QfNVfrS |
|---|---|
| Name | Butylphosphonic acid, hexadecyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 446.388882626 u |
| Formula | C26H55O3P |
| InChI | InChI=1S/C26H55O3P/c1-4-7-10-12-13-14-15-16-17-18-19-20-21-23-25-29-30(27,26-9-6-3)28-24-22-11-8-5-2/h4-26H2,1-3H3 |
| InChIKey | ZJKGUOXVMVECBJ-UHFFFAOYSA-N |
| Molecular Weight | 446.697 g/mol |
| SMILES | C(CCCCOP(CCCC)(=O)OCCCCCC)CCCCCCCCCCC |