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. 2019 Feb 3;2019:9423658. doi: 10.1155/2019/9423658

Table 3.

Phenolic compounds identified in EAF and subfractions from I. laurina by HPLC-ESI/MS2.

Fractions/Subfractions tR(min) [M – H] Exact mass Error (ppm) Fragments
m/z
Molecular formula Compound References
EAF 2.9 169.0154 169.0142 -7.1 125 C7H6O5 Gallic acid (I) [12, 13]
5.4 305.0663 305.0667 1.3 261, 219, 167/165, 125 C15H14O7 Gallocatechin (II) or Epigallocatechin (III) [14, 15]
6.9 183.0300 183.0299 -0.5 168, 124 C8H8O5 Methyl derivative of gallic acid (IV) [12]
9.1 197.0468 197.0455 -6.6 169, 124/123 C9H10O5 Ethyl gallate (V) [14, 16]
10.1 631.0956 631.0941 -2.4 479, 316, 169 C28H24O17 Myricetin-O-(O-galloyl)-hexoside (glycoside or galactoside) (VI) [17, 18]
10.7 479.0826 479.0831 1.0 316, 178 C21H19O13 Myricetin-3-O-galactoside (VII) [17, 18]
11.1 463.0904 463.0888 -3.5 316, 178 C21H19O12 Myricetin-3-O-rhamnoside (VIII) [17]
12.2 615.1007 615.0992 -2.4 463, 316/317, 178 C28H24O16 Myricetin galloyl rhamnoside (IX) [18, 19]
12.4 317.0318 317.0303 -4.7 178, 151 C15H10O8 Myricetin (X) [13, 14, 20]
12.7 447.0955 447.0933 -4.9 300/301 C21H20O11 Quercetin-3-O-rhamnoside (XI) [17, 18]
13.5 599.1044 599.1042 -0.3 447, 301, 169, 151 C28H24O15 Quercetin 3-O-alpha-(2′′-galloyl)rhamnoside (XII) [21, 22]
13.8 301.0357 301.0354 -1.0 178/179, 151 C15H10O7 Quercetin (XIII) [14]
F2 10.8 505.0999 505.0988 - 2.2 463, 316, 271, 163 C23H22O13 Myricetin-3-O-acetyl-rhamnoside (XIV) [23, 24]
F5 7.0 495.0786 495.0780 - 1.2 343, 169 C21H20O14 Digalloylquinic acid (XV) [2527]
F5 10.3 609.1482 609.1461 - 3.4 463, 316, 178 C27H30O16 Myricetin-3-O- rhamnoside -3′-O-rhamnoside (XVI) Structure proposed by the author
F6 7.7 647.0885 647.0890 0.8 495, 343, 325, 169 C28H24O18 Trigalloylquinic acid (XVII) [26]
F7 8.3 167.0355 167.0350 - 3.0 108 C8H8O4 Vanillic acid (XVIII) [28]