| SpectraBase Compound ID | FjFU3If13fa |
|---|---|
| InChI | InChI=1S/C20H35O3P/c1-4-6-7-8-9-13-17-22-24(21,20-15-11-10-12-16-20)23-18-19(3)14-5-2/h10-12,15-16,19H,4-9,13-14,17-18H2,1-3H3 |
| InChIKey | JTPRRRFZRMGMSL-UHFFFAOYSA-N |
| Mol Weight | 354.5 g/mol |
| Molecular Formula | C20H35O3P |
| Exact Mass | 354.232382 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HH86qDALsMe |
|---|---|
| Name | Phenylphosphonic acid, 2-methylpentyl octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.232381982 u |
| Formula | C20H35O3P |
| InChI | InChI=1S/C20H35O3P/c1-4-6-7-8-9-13-17-22-24(21,20-15-11-10-12-16-20)23-18-19(3)14-5-2/h10-12,15-16,19H,4-9,13-14,17-18H2,1-3H3 |
| InChIKey | JTPRRRFZRMGMSL-UHFFFAOYSA-N |
| Molecular Weight | 354.471 g/mol |
| SMILES | CCCCCCCCOP(C1=CC=CC=C1)(=O)OCC(CCC)C |