View the report above. Use the comments below if you need follow-up discussion.
The ordinary FTIR search does not support a firm compound-level identification, even though SODIUM BENZOATE is the nearest library entry. The stronger chemically supportable conclusion is that the sample is consistent with a carboxylate-containing salt and shows evidence of a six-membered ring, with an aromatic ring remaining plausible. This broader direction fits the Top-15 library pattern better than a specific named material because the retrieval confidence is very low and there is no direct reference or related-literature confirmation
Recommended next steps: Check for the characteristic benzoate ring pattern by closely inspecting the 1600-1450 cm-1 and 900-675 cm-1 regions at higher spectral quality. Compare the separation and shape of the 1546 and 1425 cm-1 bands against authenticated spectra of sodium benzoate and other metal carboxylates. Use complementary analysis such as Raman, XRD, or MS to determine whether the organic group is aromatic and to help distinguish benzoate from aliphatic carboxylates. If sodium benzoate is specifically suspected, confirm with a reference standard measured under the same sampling conditions.
| Rank | Match % | Compound | SMILES | Spectrum No. | Action |
|---|---|---|---|---|---|
| Loading library candidates... | |||||
| # | Wavenumber (cm⁻¹) | Absorbance | Assignment | Citation | Assignment status | |
|---|---|---|---|---|---|---|
| 1 | · | 2884 | 1.00 | - | - | - |
| 2 | · | 1546 | 0.80 | - | - | - |
| 3 | · | 2815 | 0.60 | - | - | - |
| 4 | · | 1425 | 0.36 | - | - | - |
| 5 | · | 794 | 0.30 | - | - | - |
| 6 | · | 2846 | 0.30 | - | - | - |
| 7 | · | 1021 | 0.27 | - | - | - |
| 8 | · | 1059 | 0.25 | - | - | - |
| 9 | · | 1357 | 0.24 | - | - | - |
| 10 | · | 1241 | 0.21 | - | - | - |
| 11 | · | 717 | 0.20 | - | - | - |
| 12 | · | 2570 | 0.20 | - | - | - |
| 13 | · | 2477 | 0.17 | - | - | - |
| 14 | · | 2671 | 0.15 | - | - | - |
| 15 | · | 654 | 0.14 | - | - | - |
| 16 | · | 3058 | 0.12 | - | - | - |
| 17 | · | 1481 | 0.11 | - | - | - |
| 18 | · | 1664 | 0.10 | - | - | - |
Use this area to continue the interpretation, ask questions, or add extra verification evidence.
FTIR.fun
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