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. 2018 Oct 4;23(10):2534. doi: 10.3390/molecules23102534

Table 1.

Chromatographic, mass spectral characteristics and tentative identification of compounds compounds in berry jams by LC-PDA-ESI/MS.

Peak No. Rt (min) Parent Ion Fragment Ion MW UV Spectra Compound Ref
Chokeberry
1 13.42 181 163 180 323 Caffeic acid [22,23,25]
2 14.79 465 303 464 355 Quercetin-3-O-galactoside
3 15.42 611 303 610 354 Quercetin-3-O-rutinoside (Rutin)
4 16.11 465 303 464 355 Quercetin-3-O-glucoside
5 16.29 - 303 302.1 364 Ellagic acid
6 21.90 - 303 302 369 Quercetin
7 10.80 449 287 449 528 Cyanidin-3-O-galactoside
8 11.57 419 287 419 517 Cyanidin-3-O-arabinoside
9 12.58 419 287 454 519 Cyanidin-3-O-xyloside
10 13.20 449 287 449 518 Cyanidin-3-O-glucoside
11 14.31 - 287 287 528 Cyanidin
Blackthorn
1 13.14 181 163 180 319 Caffeic acid [26]
2 14.47 355 181, 163 354 325 Neochlorogenic acid
3 15.19 611 303 610 354 Quercetin-3-O-rutinoside (rutin)
4 21.38 303 302 369 Quercetin
5 449 287 449 528 Cyanidin-3-O-galactoside
6 10.84 595 449, 287 595 516 Cyanidin-3-O-rutinoside
7 11.96 609 463, 301 611 524 Peonidin-3-(6″-coumaroyl) glucoside
Elderberry
1 13.39 355 181, 163 354 352 Chlorogenic acid [27]
2 15.44 611 303 610 354 Quercetin-3-O-rutinoside
3 16.14 465 303 464 355 Quercetin-3-O-glucoside
4 21.38 - 303 302 369 Quercetin
5 10.94 581 449, 287 616 518 Cyanidin-3-O-sambubioside
6 14.29 449, 287 449 518 Cyanidin-3-O-glucoside
Blackcurrant
1 11.16 301 139 300 252 4-Hydroxybenzoic acid-4-O-glucoside [12,28,29]
2 13.59 343 181, 163 343 321 Caffeic acid-4-O-glucoside
3 13.97 595 287 594 346 Kaempferol-3-O-rutinoside
4 14.59 627 319 626 355 Myricetin-3-O-rutinoside
5 15.04 465 319 646 372 Myricetin-3-O-rhamnoside
6 15.66 611 303 610 354 Quercetin-3-O-rutinoside
7 16.37 465 303 464 355 Quercetin-3-O-glucoside
8 16.70 357 195 194 316 Ferulic acid-4-O-glucoside
9 17.47 449 287 448 346 Kaempferol-3-O-galactoside
10 17.84 567 319 566 355 Myricetin-3-O-(6″-malonyl-glucoside)
11 19.25 319 300 255 Hydroxybenzoic acid-4
12 20.25 551 303 550 358 Quercetin-3-O-(6″-malonyl-glucoside)
13 21.99 303 302 369 Quercetin
14 22.53 449 287 448 346 Kaempferol-3-O-glucoside
15 22.98 287 286 365 Kaempferol
16 10.12 465 303 465 524 Delphinidin-3-O-glucoside
17 10.57 611 528 Delphinidin-3-O-rutinoside
18 11.38 595 287 449 518 Cyanidin-3-O-glucoside
19 14.38 449 287 287 514 Cyanidin
20 15.64 303 303 520 Delphinidin