RESULT PAGE

chlorinated organosilicon or other substituted organic compound containing aliphatic C-H with a carbonyl-type band

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Result No.: 20250711105741059388050 Owner: publicuser Comments: 0
FTIR Analysis Report

chlorinated organosilicon or other substituted organic compound containing aliphatic C-H with a carbonyl-type band

Sample & Measurement Parameters

Report No. 20250711105741059388050
Date 2025-07-12 06:56:52
Spectral Range (cm⁻¹) [(650, 4000)]
Baseline AsLS baseline correction
Library match 0%

Identification Result

0%

The current FTIR result does not support a firm compound-level identification. The nearest library hit is dichloro-(3-chloropropyl)-methylsilane, but the retrieval is extremely weak and the Top-15 list is chemically inconsistent, so this should not be treated as a confirmed match. The spectrum is more safely described as an uncertain chlorinated organosilicon or other substituted organic material showing aliphatic C-H absorption and a strong band near 1704 cm-1 consistent with a carbonyl-type feature. Because the leading library candidate does not itself explain the apparent carbonyl band, and no direct or related literature evidence narrows the assignment, the conclusion should remain broad

Detailed interpretation

  • Top library match: dichloro-(3-chloropropyl)-methylsilane #99
  • All listed library similarities are 0.000, S-O the nominal top hit is not a meaningful spectral match.
  • The Top-15 candidates do not show a stable shared chemistry, which weakens any narrow library-based assignment.
  • A band at 1704 cm-1 indicates a carbonyl-type group, but the named top candidate dichloro-(3-chloropropyl)-methylsilane does not contain a carbonyl functionality.
  • The carbonyl-type band at 1704 cm-1 could indicate a ketone, ester, acid derivative, or contamination/additive rather than the main bulk material.
  • The 1000-1257 cm-1 region is not specific enough here to distinguish among Si-O, Si-C, C-O, or mixed substituted organic vibrations.
  • Low-frequency bands near 660-685 cm-1 are compatible with halogenated structures but are insufficient to prove chlorination without stronger corroborating bands.
  • Because no literature-backed reference match was recovered, the present evidence supports only a broad material direction rather than a confirmed entity.

Recommended next steps: Re-run the FTIR with careful background subtraction and check whether the 1704 cm-1 band is reproducible across multiple spots or preparations. Inspect the sample by ATR and, if possible, transmission or a cleaned surface measurement to determine whether the carbonyl band arises from a surface contaminant, additive, or the bulk material. Use complementary elemental analysis such as XRF, EDS, or microanalysis to test specifically for Si and Cl, which would help evaluate the chlorinated organosilicon direction. If the sample is volatile or extractable, confirm with GC-MS; if nonvolatile, consider pyrolysis-GC-MS or NMR to determine whether a silane/siloxane component and a carbonyl-containing component are both present.

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 · 782 1.00 - - -
2 · 1000 0.76 - - -
3 · 1257 0.53 - - -
4 · 1704 0.53 - - -
5 · 1538 0.34 - - -
6 · 1402 0.28 - - -
7 · 1448 0.23 - - -
8 · 862 0.16 - - -
9 · 660 0.14 - - -
10 · 2959 0.14 - - -
11 · 685 0.13 - - -
12 · 1170 0.12 - - -
13 · 1954 0.11 - - -

Appendix — Raw Spectrum

Raw sample spectrum
Generated by FTIR.fun — Report #20250711105741059388050 2025-07-12 06:56:52
Discussion

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