| SpectraBase Compound ID | 6q3e5lRASYM |
|---|---|
| InChI | InChI=1S/C9H19O3P/c1-4-7-8-9-13(10,11-5-2)12-6-3/h8-9H,4-7H2,1-3H3/b9-8+ |
| InChIKey | QYVKJAZJWBEBJW-CMDGGOBGSA-N |
| Mol Weight | 206.22 g/mol |
| Molecular Formula | C9H19O3P |
| Exact Mass | 206.107181 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2nWU54Bm2xO |
|---|---|
| Name | Diethyl-1-pentenyl-phosphonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.107181467 u |
| Formula | C9H19O3P |
| InChI | InChI=1S/C9H19O3P/c1-4-7-8-9-13(10,11-5-2)12-6-3/h8-9H,4-7H2,1-3H3/b9-8+ |
| InChIKey | QYVKJAZJWBEBJW-CMDGGOBGSA-N |
| Molecular Weight | 206.222 g/mol |
| SMILES | C(\C=C\P(=O)(OCC)OCC)CC |
| Spectrum/Structure Validation Score (Raman) | 0.872667 |