| SpectraBase Compound ID | 8MPdQIPsiZv |
|---|---|
| InChI | InChI=1S/C20H44O6P2/c1-5-23-27(21,24-6-2)19-17-15-13-11-9-10-12-14-16-18-20-28(22,25-7-3)26-8-4/h5-20H2,1-4H3 |
| InChIKey | FQOSCOKXLMUKFA-UHFFFAOYSA-N |
| Mol Weight | 442.5 g/mol |
| Molecular Formula | C20H44O6P2 |
| Exact Mass | 442.261313 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Djq91jCqMR |
|---|---|
| Name | C12 bis Diethylphosphonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 442.261313127 u |
| Formula | C20H44O6P2 |
| InChI | InChI=1S/C20H44O6P2/c1-5-23-27(21,24-6-2)19-17-15-13-11-9-10-12-14-16-18-20-28(22,25-7-3)26-8-4/h5-20H2,1-4H3 |
| InChIKey | FQOSCOKXLMUKFA-UHFFFAOYSA-N |
| Molecular Weight | 442.514 g/mol |
| SMILES | C(P(=O)(OCC)OCC)CCCCCCCCCCCP(=O)(OCC)OCC |