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. 2017 Jan 20;22(1):168. doi: 10.3390/molecules22010168

Table 1.

General band assignments of mid-IR spectrum of plants based on the literature.

Frequency (cm−1) Definition of the Spectral Assignments
3500−3200 O-H and N-H stretch: carbohydrates, proteins, alcohols and phenolic compounds
2960−2950 CH3 asymmetric stretching: mainly lipid with a little contribution from protein, carbohydrate, and nucleic acid
2930−2920 CH2 asymmetric stretch: mainly lipid with a little contribution from protein, carbohydrate, and nucleic acid
2875−2870 CH3 symmetric stretch: mainly protein with a little contribution from lipid, carbohydrate, and nucleic acid
2860−2840 CH2 symmetric stretch: mainly lipids with a little contribution from protein, carbohydrate, and nucleic acid
1745−1730 Saturated ester C=O stretch: phospholipid, cholesterol ester, hemicellulose, pectin, lignin, suberin/cutin esters
1650−1630 Amide I (C=O stretch): protein, pectin, water associated cellulose or lignin, alkaloids
1630−1620 C=C stretch: phenolic compound
1610−1590 C=O aromatic stretch: lignin, alkaloid
1560−1540 Amide II (C=N and N–H stretch): mainly protein
1515−1505 C=C aromatic stretch: lignin
1460−1455 Amide III (aromatic hydrocarbons): mainly protein
1455−1440 C–H asym bending of CH2 and CH3: cell wall polysaccharide, lipid and protein
1430−1420 O–H bend: cell wall polysaccaride, alcohol, and carboxylic acid
1380−1370 C–H sym bending of CH2 and CH3: cell wall polysaccharide, lipid and protein
1375−1365 C–H bend: cellulose and hemicellulose
1250−1240 C=O stretch: pectic substances, lignin, hemicellulose, suberin/cutin esters
1235 Amide IV (C=N and N–H stretching): mainly protein
1235−1230 C–O stretch: lignin, xylan
1205−1200 O–H in plane bend: cellulose
1170−1160 C–O–C asym stretch: cutin
1160−1150 Symmetric bonding of aliphatic CH2, OH, or C–O stretch of various groups: cell wall polysaccaride
1145−1140 C–O–C asym stretch: cellulose (β-1.4 glucan)
1110−1105 C–O–C sym stretch: cutin
1105−1100 Antisymmetric in-phase: pectic substance
1085−1075 C–O deformation: secondary alcohol, aliphatic ester
1075−1070 C–O ring stretch: rhamnogalactorunan, b-galactan
1065−1060 C–O stretch: cell wall polysaccarides (glucomannan)
1045−1030 O–H and C–OH stretch: cell wall polysaccarides (arabinan, cellulose)
990−980 C–O stretch: cutin
900−890 C–H deformation: arabinan
895−890 C–O valence vibration: galactan
875−870 C–O stretch: β–d-fructose