RESULT PAGE

aromatic organic material with substituted benzene character and fingerprint-region bands consistent with a small-molecule or mixed organic composition

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Result No.: 20250723153335475676169 Owner: publicuser Comments: 0
FTIR Analysis Report

aromatic organic material with substituted benzene character and fingerprint-region bands consistent with a small-molecule or mixed organic composition

Sample & Measurement Parameters

Report No. 20250723153335475676169
Date 2025-07-23 07:37:21
Spectral Range (cm⁻¹) [(650, 4000)]
Baseline AsLS baseline correction
Library match 0%

Identification Result

0%

The present FTIR result does not support a firm compound-level assignment. The library top hit is retained only as the nearest named entry, but all reported similarities are 0.000 and there is no direct reference or related-literature confirmation. The measured spectrum is more safely described as an aromatic organic material showing substituted benzene character, with multiple strong fingerprint-region bands that could arise from a small organic compound or a mixture rather than a uniquely identified substance

Detailed interpretation

  • Top library match: N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid #236
  • The leading library candidate has no positive spectral support listed, and its similarity is 0.000.
  • No related-literature evidence provided a stable corroborating material direction.
  • The broad diversity of top library candidates argues against a secure identification of the top named library entry as the sample.
  • The current spectrum supports aromatic organic content, but not a defensible unique entity assignment.
  • Possible additional functionality is suggested in the 1000-1250 cm-1 region, yet the available evidence does not distinguish among amine-containing, ester-containing, halogenated, or mixed-component possibilities.
  • A mixture or formulated organic sample remains plausible because the library pattern does not converge on one consistent chemistry.

Recommended next steps: Recollect the FTIR spectrum with improved signal quality and baseline control, especially across 1800-600 cm-1, to verify the fingerprint pattern. Check specifically for any weak or broad bands in the 3200-3600 cm-1 region and any carbonyl absorption near 1700-1750 cm-1, since confirming or excluding O-H and C=O would strongly narrow the material direction. If the sample is extractable, run GC-MS for volatile or small-molecule components to test whether the spectrum represents a single aromatic compound or a mixture. If a nonvolatile residue is present, complementary Raman or NMR analysis would help determine whether the aromatic portion is a discrete substituted benzene compound or part of a more complex formulation.

Library Comparison

Match group:
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 · 728 1.00 - - -
2 · 796 0.83 - - -
3 · 748 0.80 - - -
4 · 1079 0.65 - - -
5 · 1383 0.57 - - -
6 · 1320 0.40 - - -
7 · 1614 0.39 - - -
8 · 1145 0.35 - - -
9 · 1498 0.33 - - -
10 · 1200 0.31 - - -
11 · 1022 0.29 - - -
12 · 3047 0.26 - - -
13 · 905 0.25 - - -
14 · 1452 0.24 - - -
15 · 931 0.21 - - -
16 · 988 0.18 - - -
17 · 1250 0.14 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20250723153335475676169 2025-07-23 07:37:21
Discussion

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