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. 2020 Jan 13;15(1):e0225514. doi: 10.1371/journal.pone.0225514

Table 2. Identified compounds in the HECA with their respective retention times and m/z ratio.

Number Components Empirical formula Chemical class RT (min.) MS mode Calcd. Obsd. Error
1 Catechin C15H14O6 Flavan-3-ol 1.73 [M-H]- 289.0712 289.0706 2.1
2 Epicatechin C15H14O6 Flavan-3-ol 2.03 [M-H]- 289.0712 289.0741 10.0
3 kaempferol-4-β-glucopyranoside C21H20O11 Flavonol 2.73 [M+H]+ 449.1084 449.1064 4.5
4 Quercetin-3- β-glucopyranoside C21H20O12 Flavonol 3.48 [M+H]+ 465.1033 465.1029 0.9
5 Apigenin-7-O- β-glucopyranoside C21H20O10 Flavone 3.50 [M+H]+ 433.1135 433.1136 0.2
6 Quercetin-3-O-galactopyranoside C21H20O12 Flavonol 3.62 [M+H]+ 465.1033 465.1029 0.9
7 Quercetin-3-O-arabinopyranoside C20H18O11 Flavonol 4.01 [M+H]+ 435.0927 435.0920 1.6
8 Quercetin-3-α-rhamnopyranoside C21H20O11 Flavonol 4.14 [M+H]+ 449.1084 449.1064 4.5
9 Quercetin C15H10O7 Flavonol 5.51 [M+H]+ 303.0505 303.0531 8.6
10 kaempferol-3-O-(6”-O-E-p-coumaroyl)-β-D-glucopyranoside C30H26O13 Flavonol 5.54 [M+H]+ 595.1452 595.1492 6.7
11 kaempferol-3-O-(2”-O-E-p-coumaroyl)-β-D-glucopyranoside C30H26O13 Flavonol 5.77 [M+H]+ 595.1452 595.1492 6.7
12 Kaempferol C15H10O6 Flavonol 6.49 [M-H]- 285.0399 285.0374 8.8
13 Betulinic acid C30H48O3 Terpenoid 15.00 [M-H]- 455.3525 455.3487 8.3