RESULT PAGE

oxygenated organic material consistent with an alcohol-rich aliphatic sample, possibly with ether-like C-O bonding

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Result No.: 20250623145049300776599 Owner: Mainge Comments: 0
FTIR Analysis Report

oxygenated organic material consistent with an alcohol-rich aliphatic sample, possibly with ether-like C-O bonding

Sample & Measurement Parameters

Report No. 20250623145049300776599
Date 2025-06-23 06:54:07
Spectral Range (cm⁻¹) [(650, 4000)]
Baseline AsLS baseline correction
Library match 0%

Identification Result

0%

The FTIR evidence does not support a firm identification of this sample as 2-phenylbutan-1-ol, because the library match is low-confidence and no direct or related literature evidence independently confirms that structure. The observed spectrum is more safely described as an oxygenated organic material showing a broad O-H band near 3346 cm-1, aliphatic C-H stretching near 2974 and 2893 cm-1, and strong C-O-region absorptions at 1087 and 1045 cm-1, which is consistent with an alcohol-rich aliphatic composition and possibly ether-like C-O bonding. A weak or ambiguous band near 1652 cm-1 is not enough on its own to justify a narrower structural assignment

Detailed interpretation

  • Top library match: 2-phenylbutan-1-ol #288
  • The reference library comparison confidence is low, with all listed candidates at effectively zero similarity, S-O the top hit cannot be treated as a reliable structural identification.
  • The observed peak set does not provide clear characteristic evidence for a phenyl-containing alcohol specifically.
  • The 1652 cm-1 feature is insufficiently defined to support a more specific unsaturation- or aromatic-associated assignment.
  • It remains uncertain whether the sample is a simple aliphatic alcohol, a polyol, or an alcohol-containing material with additional ether functionality.
  • The presence or absence of an aromatic ring cannot be established confidently from the current peak list alone.
  • The significance of the 878 cm-1 and 1652 cm-1 bands remains unclear without fuller spectral context and band intensities.

Recommended next steps: Acquire the full FTIR spectrum with band shapes and relative intensities, especially in the 3200-3600, 1200-900, and 900-650 cm-1 regions, to distinguish alcohol from polyol or ether-containing materials more confidently. Check specifically for aromatic-ring bands near 1600-1450 cm-1 and out-of-plane C-H bands in the 900-700 cm-1 region if 2-phenylbutan-1-ol is being considered. If available, run GC-MS or LC-MS to determine whether the sample is a discrete small molecule rather than a mixed oxygenated material. Repeat FTIR after drying the sample thoroughly, since moisture can broaden the O-H region and complicate interpretation of alcohol-rich materials.

Library Comparison

Match group:
Library spectrum will appear here.

Library Search Results — Top 15 Candidates

Rank Match % Compound SMILES Spectrum No. Action
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Peak Analysis

★ = Literature-supported assignment
# Wavenumber (cm⁻¹) Absorbance Assignment Citation Assignment status
1 · 1045 1.00 - - -
2 · 878 0.45 - - -
3 · 1087 0.42 - - -
4 · 3346 0.37 - - -
5 · 2974 0.29 - - -
6 · 1382 0.18 - - -
7 · 2893 0.16 - - -
8 · 1652 0.12 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20250623145049300776599 2025-06-23 06:54:07
Discussion

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