RESULT PAGE

secondary amine / n h

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Result No.: 20260614005046286824186 Owner: isha Comments: 0
FTIR Analysis Report Moderate confidence

secondary amine / n h

Sample & Measurement Parameters

Report No. 20260614005046286824186
Date 2026-06-13 19:34:51
Spectral Range (cm⁻¹) [(400, 4000)]
Baseline AsLS baseline correction
Library match 68%

Identification Result

68%

The FTIR spectrum matches library records of diazanium;sulfate (ammonium sulfate) with moderate confidence, but the broader Top‑15 library pattern and conflicting related‑literature evidence suggest a nitrogen‑containing material with secondary amine or ammonium character, likely accompanied by an organic component bearing carbonyl, carboxylate, and C–O functionalities. A definitive structure cannot be assigned from the present data

Detailed interpretation

  • Top library match: diazanium;sulfate #142761
  • The related‑literature interpretation describes a cellulose‑like polysaccharide backbone with C–O–C/ring modes, carbonyl, and carboxylate functionalities, which is inconsistent with a pure ammonium sulfate identification.
  • The low library similarity (0.659) and small lead gap (0.059) among the top candidates show that the spectral database alone does not confidently resolve the material.
  • The sample may be a mixture of inorganic amine/ammonium salts and organic biopolymer or carbohydrate; the observed spectral contradictions cannot be resolved without supplementary data.
  • Assignments of many low‑wavenumber peaks to metal‑oxygen or silicate‑like species in the literature are chemically incompatible with the primary amine/ammonium direction, suggesting that those features may originate from minor components or are artefacts of the library search.

Recommended next steps: Compare the spectrum directly with a reference of diazanium;sulfate (ammonium sulfate) and, if possible, with ammonium carboxylate salts to assess the contribution of the carbonyl/carboxylate bands. Employ hyphenated techniques such as TGA‑FTIR or pyrolysis‑GC‑MS to detect organic volatiles and confirm the presence of polysaccharide or amine decomposition products. Determine elemental composition by CHNS analysis to verify the nitrogen and sulfur content, clarifying whether the material is predominantly an ammonium salt or an organic amine.

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 · 1394 0.70 - - -
2 · 609 0.61 - - -
3 · 420 0.49 - - -
4 · 2039 0.48 - - -
5 · 1072 0.39 - - -
6 · 2649 0.38 - - -
7 · 1896 0.36 - - -
8 · 1014 0.35 - - -
9 · 1952 0.33 - - -
10 · 2982 0.33 - - -
11 · 2884 0.30 - - -
12 · 1590 0.29 - - -
13 · 449 0.27 - - -
14 · 884 0.21 - - -
15 · 676 0.21 - - -
16 · 2188 0.21 - - -
17 · 927 0.21 - - -
18 · 1707 0.16 - - -
19 · 525 0.16 - - -
20 · 433 0.16 - - -
21 · 829 0.12 - - -
22 · 462 0.11 - - -
23 · 2149 0.11 - - -
24 · 3680 0.07 - - -
25 · 3726 0.06 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20260614005046286824186 2026-06-13 19:34:51
Discussion

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