RESULT PAGE

oxygenated organic material with carbonyl functionality, possibly an acid/ester-like or anhydride-containing aliphatic/aromatic compound

View the report above. Use the comments below if you need follow-up discussion.

Result No.: 20250723172427589663406 Owner: publicuser Comments: 0
FTIR Analysis Report

oxygenated organic material with carbonyl functionality, possibly an acid/ester-like or anhydride-containing aliphatic/aromatic compound

Sample & Measurement Parameters

Report No. 20250723172427589663406
Date 2025-07-23 09:30:02
Spectral Range (cm⁻¹) [(650, 4000)]
Baseline AsLS baseline correction
Library match 0%

Identification Result

0%

The FTIR evidence does not support a reliable assignment to the library top hit, 2-cyclopentylacetic acid, because the library match quality is effectively absent and no direct or related literature evidence narrows the identity. The observed spectrum is better described conservatively as an oxygenated organic material containing strong carbonyl absorption, with additional bands consistent with C-O functionality and possible aromatic or substituted ring contributions. The paired carbonyl-region bands at 1774 and 1716 cm-1 especially suggest a more complex carbonyl environment than a simple saturated monocarboxylic acid alone

Detailed interpretation

  • Top library match: 2-cyclopentylacetic acid #402
  • All listed library similarities are 0.000, S-O the retrieval does not provide meaningful positive support for the top candidate or any specific named compound.
  • A simple assignment to 2-cyclopentylacetic acid is limited by the presence of two strong carbonyl-region bands, which is not securely explained by a single uncomplicated monocarboxylic acid structure.
  • It remains uncertain whether the 1774/1716 cm-1 pair reflects an anhydride-like motif, mixed carbonyl functionalities, conjugation effects, or a multi-component sample.
  • The broad band near 3417-3424 cm-1 could arise from true O-H functionality or from moisture, which affects confidence in distinguishing acid/alcohol contributions.
  • The ring-related fingerprint bands do not securely distinguish between aliphatic cyclic and aromatic substitution patterns from FTIR alone in this case.

Recommended next steps: Re-run the FTIR spectrum with improved background subtraction and sample drying to test whether the 3417-3424 cm-1 feature is intrinsic or due to moisture. Inspect the carbonyl region at higher spectral quality to determine whether the 1774 and 1716 cm-1 bands represent an anhydride-like doublet or two separate components. Acquire complementary GC-MS or LC-MS data if the sample is extractable, since the current FTIR evidence is insufficient for a defensible single-compound identification. If available, compare against authentic spectra of simple aliphatic carboxylic acids, esters, and anhydride-containing materials rather than relying on the present low-quality library ranking.

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 · 1716 1.00 - - -
2 · 3417 0.54 - - -
3 · 3424 0.54 - - -
4 · 1299 0.48 - - -
5 · 1236 0.48 - - -
6 · 2976 0.47 - - -
7 · 1774 0.40 - - -
8 · 1044 0.36 - - -
9 · 1594 0.35 - - -
10 · 1406 0.35 - - -
11 · 1452 0.34 - - -
12 · 1120 0.24 - - -
13 · 808 0.22 - - -
14 · 877 0.20 - - -
15 · 733 0.16 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20250723172427589663406 2025-07-23 09:30:02
Discussion

Comments and follow-up evidence

Use this area to continue the interpretation, ask questions, or add extra verification evidence.

Submit Requirement Form