| SpectraBase Compound ID | L9e5q5dat5Y |
|---|---|
| InChI | InChI=1S/C8H15O6P/c1-8(2)10-5-7(14-8)6-13-15(9)11-3-4-12-15/h7H,3-6H2,1-2H3 |
| InChIKey | XSQLMTVONUZXLD-UHFFFAOYSA-N |
| Mol Weight | 238.18 g/mol |
| Molecular Formula | C8H15O6P |
| Exact Mass | 238.060625 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jywr9LMLQGo |
|---|---|
| Name | 1,2-o,o-Isopropylideneglycero-3-ethylenephosphate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.060625195 u |
| Formula | C8H15O6P |
| InChI | InChI=1S/C8H15O6P/c1-8(2)10-5-7(14-8)6-13-15(9)11-3-4-12-15/h7H,3-6H2,1-2H3 |
| InChIKey | XSQLMTVONUZXLD-UHFFFAOYSA-N |
| Molecular Weight | 238.176 g/mol |
| SMILES | C1(COC(O1)(C)C)COP1(=O)OCCO1 |