RESULT PAGE

oxygenated aliphatic organic compound, most consistent with an ester containing ether-like C-O bonds

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Result No.: 20250602134317378186542 Owner: publicuser Comments: 0
FTIR Analysis Report

oxygenated aliphatic organic compound, most consistent with an ester containing ether-like C-O bonds

Sample & Measurement Parameters

Report No. 20250602134317378186542
Date 2025-06-02 18:44:48
Spectral Range (cm⁻¹) [(1100, 1400)]
Baseline AsLS baseline correction
Library match 0%

Identification Result

0%

The FTIR pattern is most consistent with a small oxygenated aliphatic material containing a strong ester carbonyl and multiple C-O stretching bands. The nearest library name is 1-methoxypropan-2-yl acetate, but the library match quality is effectively non-discriminating and there is no direct or related literature support to confirm that exact compound. A broader assignment to an oxygenated ester-like organic material is therefore the most chemically supportable conclusion for this sample

Detailed interpretation

  • Top library match: 1-methoxypropan-2-yl acetate #10829
  • All reported library similarities are 0.000, S-O the retrieval does not provide a reliable discriminating match.
  • The Top-15 library candidates include chemically unrelated structures, which limits confidence in any single narrow identity.
  • A band near 2280 cm-1 is not explained by the leading ester candidate and may reflect an impurity, background contribution, or an additional component.
  • The present evidence supports an oxygenated ester-like material direction, but not a firm assignment to a single named compound.
  • It remains uncertain whether the sample is a pure solvent-like ester, a mixture, or a formulated material containing an ester-rich component.
  • The significance of the 2280 cm-1 feature needs confirmation before a narrower structural conclusion is made.

Recommended next steps: Re-run the FTIR with careful background subtraction and confirm whether the 2280 cm-1 band persists in the sample spectrum. Check for ester confirmation by comparing the carbonyl region near 1736 cm-1 and the C-O region from about 1250 to 1000 cm-1 against an authentic spectrum of 1-methoxypropan-2-yl acetate. If the material is volatile, verify by GC-MS to determine whether a single low-molecular-weight ester dominates. If mixture is suspected, combine FTIR with GC-MS or headspace GC-MS to separate the main oxygenated component from minor contributors.

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 · 1243 1.00 - - -
2 · 1114 0.98 - - -
3 · 1736 0.95 - - -
4 · 2873 0.52 - - -
5 · 1372 0.48 - - -
6 · 2931 0.47 - - -
7 · 1018 0.36 - - -
8 · 1203 0.32 - - -
9 · 1453 0.30 - - -
10 · 965 0.28 - - -
11 · 2280 0.12 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20250602134317378186542 2025-06-02 18:44:48
Discussion

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