Table 1.
Characterization of phenolic compounds of PPE using LC-ESI/MS analysis
Component name | Expected mass (Da) | Observed m/z | Mass error (mDa) | Mass error (ppm) | Retention time (min) | Detector response | Adducts |
---|---|---|---|---|---|---|---|
(−) Epigallocatechin gallate | 458.08 | 481.07 | −0.91 | −1.88 | 3.17 | 1,926.77 | +Na, +H |
3′,4′,5,7-Tetrahydroxyisoflavanone | 288.06 | 289.07 | 0.73 | 2.51 | 3.60 | 1,129.09 | +H |
6″-O-Acetyldaidzin | 458.12 | 459.12 | −1.15 | −2.49 | 7.02 | 1,507.41 | +H |
Cyanidin 3-O-xyloside | 419.09 | 419.09 | 1.59 | 3.79 | 7.56 | 1,618.00 | −e, +H |
Dihydroquercetin 3-O-hexoside | 466.11 | 489.10 | 0.72 | 1.48 | 4.43 | 3,258.50 | +Na |
Ellagic acid | 302.00 | 303.01 | 0.37 | 1.23 | 5.69 | 119,562.75 | +H, −e, +Na |
Ellagic acid arabinoside | 434.04 | 435.05 | 0.19 | 0.43 | 5.39 | 9,050.23 | +H, +Na |
Ellagic acid glucoside | 464.05 | 465.06 | 1.43 | 3.08 | 4.27 | 4,554.70 | +H, +Na |
Epigallocatechin (−) | 306.07 | 307.08 | 0.91 | 2.98 | 1.13 | 2,386.10 | +H, +Na |
Gallagic acid | 604.01 | 604.00 | −2.72 | −4.50 | 4.17 | 1,057.14 | −e |
Gallic acid | 170.02 | 171.02 | 0.23 | 1.37 | 0.96 | 2,218.83 | +H |
Isopeonidin 3-O-sambubioside | 595.16 | 618.15 | −3.60 | −5.83 | 6.50 | 2,121.97 | +Na, −H, −e |
Kaempferol 3-(2G-rhamnosylrutinoside) | 448.10 | 471.09 | 0.42 | 0.89 | 6.49 | 22,420.06 | +Na, +H |
Kaempferol 3-O-rhamnoside | 432.10 | 433.11 | 0.44 | 1.00 | 6.48 | 2,342.33 | +H, +Na |
Leucopelargonidin | 290.07 | 291.08 | 0.43 | 1.47 | 2.35 | 1,743.90 | +H |
Methylgalangin | 286.04 | 287.05 | 0.50 | 1.74 | 6.49 | 15,837.07 | +H |
Punicalin | 782.06 | 783.06 | 1.39 | 1.77 | 4.38 | 2,813.12 | +H |
Abbreviations: ESI, electrospray ionization; LC, Liquid chromatography; MS, mass spectrometer; PPE, pomegranate peel extract.