RESULT PAGE

weakly matched nitrogen-containing organic material with possible nitrile- or carbonyl-bearing aromatic character

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Result No.: 20250422075849439257317 Owner: publicuser Comments: 0
FTIR Analysis Report

weakly matched nitrogen-containing organic material with possible nitrile- or carbonyl-bearing aromatic character

Sample & Measurement Parameters

Report No. 20250422075849439257317
Date 2025-04-22 14:03:24
Spectral Range (cm⁻¹) [(650, 4000)]
Baseline AsLS baseline correction
Library match 0%

Identification Result

0%

The FTIR search does not support a confident compound-level identification for this sample. Although the nearest library entry is N-[2-[2-(benzoylamino)phenyl]disulfanylphenyl]benzamide, all listed library similarities are 0.000 and no direct or related literature evidence narrows the assignment. The most chemically supportable reading is therefore a broad organic direction: a weakly matched nitrogen-containing material with possible nitrile and/or carbonyl functionality, potentially with aromatic character, rather than a defensible identification of the named library compound

Detailed interpretation

  • Top library match: N-[2-[2-(benzoylamino)phenyl]disulfanylphenyl]benzamide #73725
  • All top library matches have similarity 0.000, indicating an extremely weak retrieval basis.
  • The Top-1 candidate, N-[2-[2-(benzoylamino)phenyl]disulfanylphenyl]benzamide, would imply a much more specific amide/disulfide aromatic structure than is supported by the present evidence packet.
  • The Top-15 list is chemically inconsistent, containing unrelated polymers, salts, heterocycles, chlorinated aromatics, and small molecules, which limits confidence in any narrow conclusion.
  • It remains uncertain whether the 2137 cm-1 band is a true nitrile absorption, another triple-bond-region feature, or an artifact/contribution from a minor component.
  • The relationship between the high-wavenumber O-H/N-H-like bands and the main organic fingerprint is not established.
  • Possible aromatic character is suggested only broadly from the candidate pattern and low-wavenumber band distribution, not from a strong direct match.
  • The sample may be a mixture, contaminated material, or a compound absent from the reference library.

Recommended next steps: Re-measure the spectrum after careful background collection and atmospheric compensation, especially because the 2137 cm-1 and high-wavenumber bands are important to the current direction. Inspect the sample for mixture behavior and, if possible, collect replicate FTIR spectra from multiple spots or after purification/separation. Confirm the possible nitrile assignment with complementary Raman or by checking whether the 2137 cm-1 feature persists across repeated measurements. If the sample is expected to be a discrete organic compound, use GC-MS or LC-MS to determine molecular composition before attempting a narrower structural assignment.

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 · 1016 1.00 - - -
2 · 3624 0.89 - - -
3 · 763 0.64 - - -
4 · 3697 0.62 - - -
5 · 2359 0.59 - - -
6 · 1629 0.52 - - -
7 · 914 0.51 - - -
8 · 1382 0.51 - - -
9 · 1164 0.40 - - -
10 · 1869 0.28 - - -
11 · 696 0.26 - - -
12 · 1786 0.22 - - -
13 · 2000 0.21 - - -
14 · 3394 0.17 - - -
15 · 669 0.17 - - -
16 · 2996 0.16 - - -
17 · 1245 0.16 - - -
18 · 839 0.16 - - -
19 · 2137 0.15 - - -
20 · 2944 0.15 - - -
21 · 2467 0.13 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20250422075849439257317 2025-04-22 14:03:24
Discussion

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