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. 2020 Jul 30;10:12818. doi: 10.1038/s41598-020-69800-7

Table 2.

Selected wavenumbers by the SPA-SVM to distinguish healthy controls and breast cancer samples.

Selected wavenumber (cm−1) Tentative assignment
901 Phosphodiester (absorbances due to collagen and glycogen)
959 Symmetric stretching vibration of n1PO4
980 OCH3 (polysaccharides)
999 Ring stretching vibrations mixed strongly with CH in plane bending
1,018 n(CO), n(CC), d(OCH), ring (polysaccharides, pectin)
1,277 Vibrational modes of collagen
1,311 Amide III band components of proteins
1,364 Stretching C–O, deformation C–H, deformation N–H
1,402 Symmetric CH3 bending modes of the methyl groups of proteins
1,464 CH2 scissoring mode of the acyl chain of lipid
1,489 In-plane CH bending vibration
1582 Ring C–C stretch of phenyl
1626 Peak of nucleic acids due to the base carbonyl stretching and ring breathing mode
1643 Amide I band (arises from C=O stretching vibrations)
1661 n(C=C) cis in lipids and fatty acids
1742 C=O stretching mode of lipids