| SpectraBase Compound ID | 62C6IBQnIBR |
|---|---|
| InChI | InChI=1S/C14H32O5P2S2/c1-9-16-20(15,17-10-2)23-21(22,18-11-13(3,4)5)19-12-14(6,7)8/h9-12H2,1-8H3 |
| InChIKey | JNGDVERLEFXGQK-UHFFFAOYSA-N |
| Mol Weight | 406.5 g/mol |
| Molecular Formula | C14H32O5P2S2 |
| Exact Mass | 406.11664 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CUz1OIJLT6R |
|---|---|
| Name | S-(Diethoxyphosphoryl)dineopentyl thiophosphate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 406.116640469 u |
| Formula | C14H32O5P2S2 |
| InChI | InChI=1S/C14H32O5P2S2/c1-9-16-20(15,17-10-2)23-21(22,18-11-13(3,4)5)19-12-14(6,7)8/h9-12H2,1-8H3 |
| InChIKey | JNGDVERLEFXGQK-UHFFFAOYSA-N |
| Molecular Weight | 406.473 g/mol |
| SMILES | C(OP(=O)(OCC)SP(=S)(OCC(C)(C)C)OCC(C)(C)C)C |