| SpectraBase Compound ID | HNbNFmAPdeN |
|---|---|
| InChI | InChI=1S/C7H17O4P/c1-5-10-12(8,9)11-6-7(2,3)4/h5-6H2,1-4H3,(H,8,9) |
| InChIKey | SDJCWFPXNUWIIN-UHFFFAOYSA-N |
| Mol Weight | 196.18 g/mol |
| Molecular Formula | C7H17O4P |
| Exact Mass | 196.086446 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Ja16BXrCXs |
|---|---|
| Name | Ethyl_Neopentyl_Phosphate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.086446021 u |
| Formula | C7H17O4P |
| InChI | InChI=1S/C7H17O4P/c1-5-10-12(8,9)11-6-7(2,3)4/h5-6H2,1-4H3,(H,8,9) |
| InChIKey | SDJCWFPXNUWIIN-UHFFFAOYSA-N |
| Molecular Weight | 196.183 g/mol |
| Nominal Mass | 196 u |
| SMILES | C(OP(=O)(O)OCC(C)(C)C)C |