Table 1.
N |
t
R
(min) |
UV maximum (nm) | (M–H)−
m/z |
Fragments (MS/MS) m/z | Tentative structural assignment |
---|---|---|---|---|---|
1 | 4.7 | 222, 271 | 169.01 | 125.02 | Gallic acid |
2 | 13.0 | 220, 225 (sh), 280, 320 | 311.04 | 179.04, 149.01, 135.05 | Caffeic acid pentose ester |
3 | 14.1 | 218, 230 (sh), 280, 325 | 311.04 | 179.04, 149.01, 135.05 | Caffeic acid pentose ester |
4 | 15.1 | 205, 225 (sh), 280 | 577.14 | 425.09, 407.08, 289.07, 245.08, 125.03 | Procyanidin dimer (epi/catechin dimer) |
5 | 16.4 | 205, 230 (sh), 280 (sh), 315 (sh) |
295.05 | 163.04, 149.01, 119.05 | Coumaric acid pentose ester |
6 | 17.4 | 205, 225 (sh), 280 | 865.21 | 407.08, 289.07, 125.03 | Procyanidin trimer (epi/catechin trimer) |
7 | 17.7 | 220, 280 | 729.16 | 407.08, 289.07, 245.08, 169.02, 125.03 | Procyanidin dimer gallate |
8 | 18.2 | 200, 260, 355 | 615.11 | 463.09, 301.04, 300.03, 271.03, 255.03, 179.00, 151.01, 169.02, 125.03 | Quercetin 3-O-hexoside gallate |
9 | 18.5 | 210, 250, 356 | 609.16 | 301.04, 300.03, 271.02, 255.03, 179.00, 151.01 | Rutin: Quercetin 3-O-rhamnosyl (1→6) hexoside |
10 | 19.4 | 210, 278 | 441.09 | 289.07, 245.08, 169.02, 125.03 | Epicatechin gallate |
11 | 19.6 | 200, 260, 355 | 463.09 | 301.04, 300.03, 271.02, 255.03, 179.00, 151.00 | Quercetin 3-O-hexoside |
12 | 21.1 | 200, 265, 345 | 599.11 | 447.10, 285.04, 284.03, 255.03, 227.04, 169.02, 125.03 | Kaempferol 3-O-galloyl hexoside |
13 | 22.0 | 200, 265, 345 | 447.10 | 285.04, 284.03, 255.03, 227.04 | Kaempferol 3-O-hexoside |
14 | 28.4 | 220, 290 (sh), 318 | 441.09 | 295.05, 277.04, 163.04, 145.03, 119.05 | Dicoumaroyl pentose |
15 | 29.0 | 220, 290 (sh), 315 | 441.09 | 295.05, 277.04, 163.04, 145.03, 119.05 | Dicoumaroyl pentose |