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The spectrum is best explained by ethyl 2-diethoxyphosphorylacetate, a phosphonate ester, based on a high library similarity (0.928) and close agreement of multiple literature‑reported phosphonate ester bands FTIR In-Depth Interpretation was not selected for this task, so this section shows the library-search result only and no deep AI interpretation was run.
Recommended next steps: Compare the sample spectrum with an authentic ethyl 2‑diethoxyphosphorylacetate standard to confirm the full band profile. Acquire ³¹P NMR or Raman data to unambiguously identify the phosphonate environment and rule out overlapping ester mixtures. Perform thermal analysis (TGA/DSC) to assess sample purity and detect any inorganic contaminants that could account for the 668 and 1407 cm⁻¹ peaks.
| Rank | Match % | Compound | SMILES | Spectrum No. | Action |
|---|---|---|---|---|---|
| Loading library candidates... | |||||
| # | Wavenumber (cm⁻¹) | Absorbance | Assignment | Citation | Assignment status | |
|---|---|---|---|---|---|---|
| 1 | · | 1708 | 1.00 | - | - | - |
| 2 | · | 1013 | 0.92 | - | - | - |
| 3 | · | 725 | 0.89 | - | - | - |
| 4 | · | 1266 | 0.76 | - | - | - |
| 5 | · | 1102 | 0.64 | - | - | - |
| 6 | · | 1117 | 0.53 | - | - | - |
| 7 | · | 1163 | 0.48 | - | - | - |
| 8 | · | 668 | 0.36 | - | - | - |
| 9 | · | 872 | 0.28 | - | - | - |
| 10 | · | 1407 | 0.18 | - | - | - |
| 11 | · | 1388 | 0.17 | - | - | - |
| 12 | · | 1455 | 0.16 | - | - | - |
| 13 | · | 2952 | 0.11 | - | - | - |
Use this area to continue the interpretation, ask questions, or add extra verification evidence.
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