| SpectraBase Compound ID | ILpvtQUSQPp |
|---|---|
| InChI | InChI=1S/C8H19O4P/c1-4-7-8(9)13(10,11-5-2)12-6-3/h8-9H,4-7H2,1-3H3 |
| InChIKey | QGNCNQNIDOVSQB-UHFFFAOYSA-N |
| Mol Weight | 210.21 g/mol |
| Molecular Formula | C8H19O4P |
| Exact Mass | 210.102096 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | JmYYf6AEdcN |
|---|---|
| Name | rac-Diethyl-(1-hydroxybutyl)-phosphonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.102096086 u |
| Formula | C8H19O4P |
| InChI | InChI=1S/C8H19O4P/c1-4-7-8(9)13(10,11-5-2)12-6-3/h8-9H,4-7H2,1-3H3 |
| InChIKey | QGNCNQNIDOVSQB-UHFFFAOYSA-N |
| Molecular Weight | 210.210 g/mol |
| SMILES | C(O)(CCC)P(=O)(OCC)OCC |
| Spectrum/Structure Validation Score (Raman) | 0.950078 |