IR Spectroscopy of Everyday Materials

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April 1st 2026
Thermo Scientific Nicolet 380 FT-IR Spectrometer (ATR mode)

Overview

Fourier-transform infrared (FT-IR) spectroscopy identifies the polar covalent bonds in a material by measuring which infrared frequencies it absorbs. Different functional groups — O-H, C=O, C-H, N-H, and others — vibrate at characteristic frequencies, producing a unique absorption fingerprint for each compound. This survey of common household and laboratory materials uses the FT-IR spectrometer in ATR mode to capture each sample’s spectrum across the mid-infrared range (~550–4000 cm⁻¹), building a reference library of spectra and identifying characteristic functional group signatures in everyday substances.

Setup

Category Details
Instrument Thermo Scientific Nicolet 380 FT-IR Spectrometer
Mode Attenuated Total Reflectance (ATR)
Range ~550–4000 cm⁻¹
Resolution ~7,150 data points per spectrum
Runs Two sessions (19 + 6 samples)
Software Thermo Scientific OMNIC 8

A background spectrum was collected first to establish a baseline. Each sample was placed directly on the ATR crystal — in ATR mode, an infrared beam reflects internally within the crystal and an evanescent wave penetrates a few microns into the sample surface, so samples can be measured as-is without any preparation. A spectrum was acquired across the mid-IR range and the raw CSV exported from OMNIC 8.

Samples

Samples
Category Samples
Solvents acetone, isopropanol, water
Food/minerals coffee, salt, sugar
Personal care soap, shampoo, conditioner, lotion, sunscreen, cleaner
Polymers plastic bag, plastic cap, plastic glove, plastic wrapper
Paper paper, paper-plastic cup
Biological finger, leaf, orange peel
Control background

Data

Raw spectra are available as CSV files each containing two columns (wavenumber in cm⁻¹ and transmittance in %) with ~7,150 data points per spectrum. Data is organized into two experimental runs: ONE (19 samples) and TWO (6 samples) over two different days.

Methods

The instrument (Nicolet 380) applies background correction automatically — each sample’s transmittance is already measured relative to the background spectrum, so non-absorbing regions read ~100% transmittance. The data cleaning pipeline:

  1. Parse — raw CSVs use scientific notation with no headers; each file was parsed into numeric wavenumber and transmittance columns.
  2. Convert to absorbance — transmittance was converted using A = −log₁₀(T/100), where T is transmittance in percent. Absorbance is dimensionless and directly proportional to concentration via the Beer-Lambert law.
  3. Export — all 23 samples were saved as individual cleaned CSVs with headers (wavenumber, transmittance, absorbance) into a single SCRUBBED folder.

All spectra plots, peak identification, and category overlays were generated from the cleaned data using Python libraries in the analysis notebook.

Results

Representative Samples

Acetone spectrum

Acetone shows a textbook IR spectrum. The dominant peak at ~1,715 cm⁻¹ is the C=O carbonyl stretch — the strongest and most characteristic absorption in ketones. The C–H methyl stretches appear around 2,950–3,000 cm⁻¹, the peaks at ~1,350–1,450 cm⁻¹ are C–H bending (symmetric and asymmetric scissoring of the CH₃ groups), and the sharp peaks in the 1,000–1,300 cm⁻¹ region correspond to C–O and C–C skeletal stretches. The absence of a broad O–H band confirms the sample is anhydrous.

Water spectrum

Water produces the classic broad O–H stretching band centered around 3,300 cm⁻¹, spanning nearly the entire 3,000–3,600 cm⁻¹ region due to hydrogen bonding. The sharp peak at ~1,640 cm⁻¹ is the O–H bending (scissoring) mode. The strong absorption rising below 1,000 cm⁻¹ is the librational (rocking) mode of liquid water.

Salt spectrum

Salt (NaCl) is an ionic compound with no covalent bonds, so it produces a nearly flat baseline with no characteristic IR absorptions. The small features visible are likely surface moisture (trace O–H) and atmospheric CO₂ interference. This makes salt an effective negative control and explains why NaCl is traditionally used for IR sample windows.

Plastic Bag spectrum

Polyethylene (plastic bag) shows an almost pure C–H spectrum. The sharp doublet at ~2,920 and ~2,850 cm⁻¹ corresponds to asymmetric and symmetric C–H stretching of the CH₂ backbone. The C–H bending peaks at ~1,460 cm⁻¹ (scissoring) and ~720 cm⁻¹ (rocking) complete the picture. No O–H, C=O, or other heteroatom peaks — just carbon and hydrogen.

Sugar spectrum

Sugar (sucrose) shows a broad O–H stretching band at 3,000–3,500 cm⁻¹ from its many hydroxyl groups, plus a rich fingerprint region below 1,500 cm⁻¹ dominated by C–O stretching vibrations of the glycosidic bond and sugar ring. The complexity of the fingerprint region reflects the molecule's size — each sugar has a unique IR fingerprint that can be used for identification.

Household Categories

Solvents spectra

Three solvents with very different bonding. Water dominates with its broad O–H stretch centered at ~3,300 cm⁻¹ and sharp O–H bend at ~1,640 cm⁻¹. Isopropanol combines a broad O–H band (hydrogen-bonded alcohol) with strong C–H stretches at ~2,950 cm⁻¹ and a rich C–O stretching region around 1,000–1,150 cm⁻¹. Acetone stands out with its sharp C=O carbonyl peak at ~1,715 cm⁻¹ — the hallmark of a ketone — and no O–H band, confirming it is anhydrous.

Food / Minerals spectra

Coffee produces a broad O–H band around 3,300 cm⁻¹ (water and hydroxyl groups in organic acids) plus C=O and C–O absorptions in the fingerprint region from caffeine, chlorogenic acids, and lipids. Sugar (sucrose) shows a similarly broad O–H region from its many hydroxyl groups, but its fingerprint region below 1,500 cm⁻¹ is dominated by intense C–O stretching vibrations of the glycosidic bond and sugar ring — each sugar has a unique fingerprint here. Salt (NaCl) is the outlier: as a purely ionic compound with no covalent bonds, it produces an almost perfectly flat baseline — no IR-active vibrations to absorb.

Personal Care spectra

Personal care products are complex mixtures but share common signatures. All six samples show a broad O–H/N–H band at 3,000–3,500 cm⁻¹ from water, glycerin, and fatty alcohols. The C–H stretches at ~2,920/2,850 cm⁻¹ reflect long-chain fatty acids and surfactants. Soap and cleaner stand out with sharper C–H peaks and stronger fingerprint absorptions, while shampoo, conditioner, and lotion cluster together — unsurprising given their similar water-and-surfactant formulations. Sunscreen diverges with additional C=O absorption from UV-filtering compounds.

Polymers spectra

Four plastic samples show that not all polymers are alike. Plastic bag (polyethylene) and plastic wrapper both display the classic PE signature: sharp C–H doublet at ~2,920/2,850 cm⁻¹ with minimal other absorptions. Plastic cap (polypropylene) adds a methyl C–H shoulder and extra bending peaks. Plastic glove (nitrile or vinyl) is the outlier — its spectrum includes C=O, C–O, and possible C≡N stretches, revealing a more complex polymer with heteroatom functional groups.

Paper spectra

Paper is primarily cellulose — the broad O–H stretch at 3,000–3,500 cm⁻¹ comes from hydroxyl groups along the polysaccharide chain, and the strong C–O absorptions at 1,000–1,150 cm⁻¹ are characteristic of the glycosidic linkages. The paper-plastic cup overlays a polyethylene coating on the cellulose base: the added C–H stretches at ~2,920/2,850 cm⁻¹ reveal the PE lining, while the underlying O–H and C–O bands from the paper substrate remain visible.

Biological spectra

Biological samples are chemically rich. Finger (skin) shows amide I (~1,640 cm⁻¹) and amide II (~1,540 cm⁻¹) bands from keratin protein, plus lipid C–H stretches and a broad O–H/N–H region. Leaf combines cellulose signatures (O–H, C–O) with cuticle wax C–H peaks and possible chlorophyll absorptions. Orange peel is dominated by terpene and essential oil signatures — strong C–H stretches, a C=O band from citric acid or esters, and complex C–O absorptions from pectin and sugars in the rind.

Chemical Categories

O–H dominant spectra

Water, coffee, sugar, lotion, shampoo, conditioner — all share the broad O–H stretching band at 3,200–3,600 cm⁻¹ as their most prominent feature. Whether the hydroxyl comes from liquid water, dissolved sugars, or glycerin in cosmetics, the hydrogen-bonded O–H stretch dominates the spectrum. The fingerprint regions diverge — sugar and coffee show rich C–O patterns while the personal care products are smoother — but the O–H signature ties them together.

C–H dominant spectra

Plastic bag, plastic cap, plastic wrapper (×2) — polyolefin plastics made almost entirely of carbon and hydrogen. The sharp C–H stretching doublet at ~2,920/2,850 cm⁻¹ and C–H bending at ~1,460 cm⁻¹ are virtually the only features. These spectra overlap closely because the underlying polymer (polyethylene or polypropylene) is chemically simple — long hydrocarbon chains with no heteroatoms.

Carbonyl spectra

Acetone, sunscreen — both produce a strong C=O carbonyl stretch at ~1,715 cm⁻¹. In acetone it's the ketone carbonyl; in sunscreen it's from UV-absorbing compounds (avobenzone, octinoxate) that contain ester or ketone groups. Despite being very different products, the carbonyl peak is the defining spectral feature in both.

Mixed organic spectra

Isopropanol, soap, cleaner, orange peel — these samples show multiple functional groups without any single one dominating. Isopropanol has O–H, C–H, and C–O all in balance. Soap and cleaner contain fatty acid salts with C–H chains plus carboxylate groups. Orange peel is a natural mixture of terpenes, citric acid, pectin, and essential oils — producing a busy spectrum with contributions from nearly every region.

Cellulose spectra

Paper, paper (run 2), paper-plastic cup, leaf — all contain cellulose as the structural backbone. The characteristic pattern is a broad O–H band (hydroxyl groups along the polysaccharide chain) combined with strong C–O stretching at 1,000–1,150 cm⁻¹ from glycosidic linkages. The paper-plastic cup adds polyethylene C–H peaks on top of the cellulose base. Leaf includes additional cuticle wax signatures but the underlying cellulose framework is clearly visible.

Protein / amide spectra

Finger (skin), plastic glove — an unexpected pairing. Human skin (keratin) shows the classic amide I band at ~1,640 cm⁻¹ and amide II at ~1,540 cm⁻¹ from protein peptide bonds. The plastic glove (nitrile or vinyl) also shows amide-like absorptions from its polymer structure. Both spectra feature these mid-range carbonyl/nitrogen bands that distinguish them from the simpler hydrocarbon or hydroxyl-dominated groups.

Ionic spectra

Salt — NaCl is purely ionic with no covalent bonds, so it has no IR-active vibrations and produces an essentially flat baseline. The minor features are trace surface moisture and atmospheric CO₂. Salt stands alone as the only sample with no molecular absorption signature — which is precisely why NaCl has historically been used to make IR-transparent windows and pellets.

See the static notebook or run the reproducible analysis yourself.