| SpectraBase Compound ID | AAv0vWgZxz4 |
|---|---|
| InChI | InChI=1S/C12H23O8P/c1-11(2,3)9(13)17-7-19-21(15,16)20-8-18-10(14)12(4,5)6/h7-8H2,1-6H3,(H,15,16) |
| InChIKey | KBLSOCYEWZSBJM-UHFFFAOYSA-N |
| Mol Weight | 326.28 g/mol |
| Molecular Formula | C12H23O8P |
| Exact Mass | 326.113055 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E83CAIgoLTb |
|---|---|
| Name | bis-(Pivaloyloxymethyl)-phosphate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.113054691 u |
| Formula | C12H23O8P |
| InChI | InChI=1S/C12H23O8P/c1-11(2,3)9(13)17-7-19-21(15,16)20-8-18-10(14)12(4,5)6/h7-8H2,1-6H3,(H,15,16) |
| InChIKey | KBLSOCYEWZSBJM-UHFFFAOYSA-N |
| Molecular Weight | 326.282 g/mol |
| Nominal Mass | 326 u |
| SMILES | C(OP(=O)(OCOC(=O)C(C)(C)C)O)OC(=O)C(C)(C)C |