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. 2022 Oct 25;12:17885. doi: 10.1038/s41598-022-22683-2

Table 1.

Assignment of ATR-FTIR peaks for phosphates in solution based on Guan et al.32, Lu et al.33, Michelmore et al.31, Socrates34, and Wan et al.35.

Phosphate type pH Species Wavenumber (cm−1) Assignment (free in solution)
Orthophosphate 3.7 H2PO4 1157 vas(P–O)
1075 vs(P–O)
940 vas(P–OH)
872 vs(P–OH)
9.1 HPO42− 1075 vas(P–O)
990 vs(P–O)
850 vs(P–OH)
12.5 PO43− 1008 vas(P–O)
Tripolyphosphate 6–9 1212 vas(P–O)
1191–1199 vas(P–O in terminal HPO3 and H2PO3)
1120 vas(P–O) in PO3
1101 vas(P–OH in H2P3O10)
1060 vs(P–OH H2P3O10)
1029 vs(P–O in terminal PO3)
1002 vs(P–OH)
975 vas(P2O74−)
905 vas(P–O–P)
Trimetaphosphate 6–9 1260 vas(P–O)
1150 vs(P–O)
1086 vs(P–O)
1002 vb(P–O)
902 vas(P–O–P)
Hexametaphosphate 6–9 1260 vas(P–O)
1115 vs(P–O)
1090 vas(P–O)
1030 vb(P–O)
1008 vb(P–O)
882 vas(P–O–P)
868 vs(P–O–P) in long chain

vas—asymmetric stretching vibration, vs—symmetric stretching vibration, vb—bending vibration.