RESULT PAGE

Ester‑rich organic material with inorganic filler (likely clay or metal oxide)

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Result No.: 20251023092226209625177 Owner: publicuser Comments: 0
FTIR Analysis Report Low confidence

Ester‑rich organic material with inorganic filler (likely clay or metal oxide)

Sample & Measurement Parameters

Report No. 20251023092226209625177
Date
Spectral Range (cm⁻¹) N/A
Baseline AsLS baseline correction
Library match 29%

Identification Result

29%

The FTIR spectrum is dominated by aliphatic hydrocarbon and ester carbonyl absorptions, suggesting a saturated polyester or analogous ester‑based organic phase. However, several low‑frequency bands indicate the presence of an inorganic component, most likely a phyllosilicate or metal oxide filler. The overall spectral pattern is consistent with a hybrid organic‑inorganic composite, though the precise composition remains uncertain 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.

Detailed interpretation

  • Top library match: SATURATED POLYESTER #67293
  • The 1082 cm⁻¹ band can also be attributed to ν₃(F₂) antisymmetric phosphate stretching [9], which is not typical of a pure polyester and suggests an inorganic phosphate or silicate phase.
  • Literature assignment of the 1176 cm⁻¹ band to fluorine [2] is not compatible with the predominant organic ester chemistry; this may indicate either a misinterpretation or a minor fluorinated contaminant, but it challenges a clean polyester identification.
  • The metal–oxygen vibration at 755 cm⁻¹ [3] is absent in pure saturated polyesters, indicating a significant inorganic component not accounted for by the library label.
  • The library match to SATURATED POLYESTER has very low confidence (similarity index ~0.0) and the top‑15 candidates show broad structural variation, S-O the exact chemical identity of the organic phase cannot be specified.
  • The nature of the inorganic filler (clay mineral, metal oxide, or phosphate) is inferred only from the 755 and 1082 cm⁻¹ bands; these assignments are plausible but require confirmation by complementary techniques.
  • The 3536 cm⁻¹ band could also contain contributions from N–H stretching [6], introducing ambiguity about the presence of amide or amine groups.

Recommended next steps: Perform X‑ray diffraction (XRD) or X‑ray fluorescence (XRF) to identify the crystalline inorganic phase(s) and quantify filler content. If the organic phase is polymeric, use pyrolysis‑GC/MS or solution‑state NMR to confirm the ester backbone and determine monomer composition. Acquire a higher‑quality spectrum with attenuated total reflectance (ATR) to improve band resolution in the 1200–1000 cm⁻¹ region and clarify the potential phosphate/silicate overlap.

Library Comparison

Library spectrum will appear here.

Library Search Results — Top 15 Candidates

Rank Match % Compound SMILES Spectrum No. Action
Loading library candidates...

Peak Analysis

★ = Literature-supported assignment
# Wavenumber (cm⁻¹) Absorbance Assignment Citation Assignment status
1 · 1732 1.00 - - -
2 · 1176 0.79 - - -
3 · 1140 0.76 - - -
4 · 1082 0.61 - - -
5 · 1378 0.56 - - -
6 · 2934 0.55 - - -
7 · 1461 0.48 - - -
8 · 1418 0.42 - - -
9 · 988 0.37 - - -
10 · 2873 0.35 - - -
11 · 755 0.30 - - -
12 · 3536 0.12 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20251023092226209625177
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