结果页面

Aliphatic-aromatic polyamide / amide-containing polymer with possible methacrylate/acrylate character

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结果编号: 20250913210157530392244 所有者: publicuser 评论: 0
FTIR分析报告 LLM置信度

Aliphatic-aromatic polyamide / amide-containing polymer with possible methacrylate/acrylate character

样品与测量参数

报告编号 20250913210157530392244
日期
光谱范围 (cm⁻¹) N/A
基线 AsLS基线校正
库匹配 36%

鉴定结果

36%

样品呈现仲酰胺(聚酰胺)材料的特征图谱,具有强酰胺I(1633 cm⁻¹)、酰胺II(1536 cm⁻¹)和N–H伸缩(3292 cm⁻¹),伴有显著的脂肪族C–H伸缩(2928、2855 cm⁻¹)以及与酰胺III/CH₂摇摆(1261 cm⁻¹)和C–N/C–O振动(1120–1198 cm⁻¹)一致的谱带。参考谱库比较建议脂肪族酰胺(N-hexylhexanediamide)为最佳匹配,但更广泛的谱库共识和光谱特征指向芳香族贡献和可能的甲基丙烯酸酯/丙烯酸酯残留,尽管未观察到明显的酯羰基。总体分类为芳香族-脂肪族富酰胺聚合物,但由于搜索相似度低(15%),无法精确确定实体。FTIR In-Depth Interpretation未针对此任务选择,因此本节仅显示谱库搜索结果,未运行深度AI解释。

详细解读

  • 最佳库匹配: N-hexylhexanediamide #76695
  • Direct literature evidence tentatively links 682 cm⁻¹ to ‘halo’ [5] and 956 cm⁻¹ to ‘metal‑oxo’ [4]; these assignments come from wholly different material systems (polysaccharides, vanadium oxide nanofibers) and do not fit the polyamide hypothesis, but they highlight that these peaks could have alternative origins if the material is a composite or contaminated.
  • The library confidence is low (15 %) and the top hit (N‑hexylhexanediamide) is only one possible aliphatic amide; the exact chain length, aromatic substitution, or presence of minor methacrylate/acrylate C-O‑monomers cannot be determined from IR alone.
  • Several candidates in the library’s top‑15 list contain methacrylate or acetate motifs, introducing the possibility of a copolymer or a mixed sample, but the current spectral evidence does not support a major ester component.

推荐的后续步骤: Compare the spectrum with reference data for known polyamides (e.g., Nylon 6, Nylon 6/6, N‑hexylhexanediamide) and with aromatic polyamide resins to narrow the structural type. Use complementary techniques such as ¹H/¹³C NMR, mass spectrometry (Py‑GC/MS or MALDI‑ToF), and elemental analysis to confirm the backbone composition and the presence of aromatic rings or additional functional groups. Perform a solvent extraction or pyrolysis to isolate components if a blend is suspected, and acquire reference spectra of the individual candidates for rigorous library search.

库对比

谱库光谱将显示在此处。

库搜索结果——前15个候选

排名 匹配% 化合物 SMILES 光谱编号 操作
正在加载数据库候选...

峰值分析

★ = 文献支持的指认
# 波数 (cm⁻¹) 吸光度 归属 引用 归属状态
1 · 1633 1.00 - - -
2 · 1536 0.85 - - -
3 · 682 0.53 - - -
4 · 1261 0.40 - - -
5 · 1460 0.39 - - -
6 · 3292 0.39 - - -
7 · 1198 0.35 - - -
8 · 1415 0.35 - - -
9 · 2928 0.31 - - -
10 · 1370 0.31 - - -
11 · 1168 0.30 - - -
12 · 2855 0.25 - - -
13 · 1120 0.20 - - -
14 · 956 0.19 - - -
15 · 2360 0.18 - - -

附录——原始光谱

原始样本光谱
生成者 FTIR.fun — 报告 #20250913210157530392244
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