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. 2020 Jul 17;9(7):628. doi: 10.3390/antiox9070628

Table 2.

Phenolic compounds identified as free and bound forms in banana passion fruit pulp.

Peak N Compound RT (min) Molecular Formula Calculated Mass [M−H]− Experimental Mass [M−H]− Error (ppm) mSigma In Source Fragments
1 quinic acid 0.79 C7H12O6 191.0197 191.0268 8.8 14.2
2 citric acid 0.94 C6H8O7 191.0197 191.027 8.2 12.4
3 dicaffeoylquinic acid derivative1 1.48 C22H28O14 515.1406 515.1413 8.1 18.6 353.0976, 191.0267, 179.0674
4 dicaffeoylquinic acid derivative 2 1.86 C22H28O14 515.1406 515.1413 −1.2 19.4 353.0976, 191.0267, 179.0674
5 (epi)gallocatechin 2.01 C15H14O7 305.0667 305.0671 −4.1 24.1 191.0294
6 dicaffeoylquinic acid derivative 3 2.15 C22H28O14 515.1406 515.141 −0.3 24.5 353.0976, 191.0271, 179.0503
7 caffeoyltartaric acid derivative 2.38 C22H24O15 527.1042 527.105 −1.5 15.2 469.0998, 349.0535, 191.0285
8 (epi)-azfelechin glucoside derivative 2.95 C27H30O16 609.1402 609.1442 2.6 9.1 527.1062, 353.0854, 191.0272
9 3,4-dihydroxybenzoic acid (protocatechuic) 2.98 C7H6O4 153.0193 153.0152 −3.6 13 -
10 syringic acid 3.55 C9H10O5 197.0455 197.0415 −5.1 40.2 179.0342, 167.0405, 123.0528
11 (epi)gallocatechin 4.14 C15H14O7 305.0667 305.0669 −1.5 13.9 -
12 (epi)gallocatechin 4.32 C15H14O7 305.0667 305.0777 −3.0 16.4 219.1106, 191.0266
13 (epi)gallocatechin 4.37 C15H14O7 305.0667 305.0773 −3.0 16.9 219.0607, 191.0271
14 (epi)gallocatechin 4.48 C15H14O7 305.0667 305.0773 −2.9 15.8 219.0607, 191.0271
15 (epi)gallocatechin-(epi)catechin 4.72 C30H26O13 593.1301 593.1377 −7.2 13.1 527.1595, 353.0831, 191.0279
16 myricetin hexoside isomer 5.21 C21H20O13 479.0831 479.0881 −6.0 7.1 329.0988, 219.0590, 173.015
17 4-hydroxybenzoic acid 5.34 C7H6O3 137.0244 137.0297 −4.7 8.9 155.0405
18 Kaempferol-methoxy-methyl ether 5.68 C17H14O7 329.0878 329.0892 −8.8 16.8 -
19 catechin hexoside 6.10 C21H24O11 451.1246 451.1262 −5.8 13 365.1499, 289.0896
20 (epi)catechin-(epi)catechin 6.16 C30H24O12 575.1195 575.1176 −4.5 32.2 375.0857, 287.0674
21 (epi)gallocatechin-(epi)catechin 6.45 C30H26O13 593.1301 593.1386 −6.2 8.5 289.0786
22 procyanidin trimer 6.53 C45H38O20 897.1884 897.1867 −3.6 40.5 479.1002, 425.0999, 289.0788
23 syringic acid isomer 6.58 C9H10O5 197.0455 197.0429 −3.5 8.5 179.0428, 165.0259
24 (epi)catechin-(epi)catechin 6.66 C30H26O12 577.1351 577.1327 −5.4 8.7 425.1043, 289.0572
25 (epi)azfelechin glucoside derivative 6.77 C27H30O16 609.1402 609.1441 3.4 18.5 289.0815
26 (epi)gallocatechin 6.90 C15H14O7 305.0667 305.0666 −2.4 3.8
27 catechin 7.15 C15H14O6 289.0718 289.0721 −3.6 2.2
28 isoquercitrin 7.27 C21H20O12 463.0882 463.0841 −3.3 15.2 329.0981, 289.0823, 175.0313
29 (epi)catechin-glucoside 7.54 C21H24O11 451.1246 451.1293 −3.6 5.7 289.0811, 229.1064
30 (epi)catechin-glucoside 7.60 C21H24O11 451.1246 451.1284 −3.5 9 289.0789, 229.106
31 caffeic acid 7.74 C9H8O4 179.035 179.0311 −4.4 19.4 135.0506
32 (epi)gallocatechin-(epi)catechin 7.94 C30H26O13 593.1301 593.1393 −3.5 17.6 407.1109, 289.0777
33 (epi)catechin-(epi)catechin 8.04 C30H26O12 577.1351 577.1353 −2.9 10.8 451.1465, 327.1182, 289.1005
34 trihydroxy(iso)flavanol-(epi)catechin 8.76 C30H26O11 561.1402 561.1471 −3.1 8 409.1127, 289.1006
35 eriodictyol-O-hexoside 8.97 C21H22O11 449.1242 449.1234 −32.1 5.8 317.1382, 191.0213, 179.059
36 luteolin-6-C-glucoside (orientin) 8.99 C21H20O11 447.0933 447.0978 −3.4 9.9 431.1019, 377.1054
37 catechin deoxyhexose 9.08 C21H24O10 435.1297 435.123 −3.6 3.3 317.1349, 289.1005, 173.0148
38 catechin deoxyhexose 9.23 C21H24O10 435.1297 435.1228 −3.1 6.2 317.1156, 289.0993
39 (epi)gallocatechin-(epi)catechin 9.26 C30H26O13 593.1301 593.1318 −3.6 29.2 289.0815, 179.0423
40 (epi)gallocatechin-(epi)catechin 9.39 C30H26O13 593.1301 593.1398 −3.3 12.9 289.0843, 179.0432
41 parasorboside 9.41 C12H20O8 291.1085 291.1094 −3.2 4.8 173.0161
42 (epi)fisetinidol 9.51 C15H14O5 273.0768 273.0766 2.1 10.3 149.0343
43 lucenin-2,4-methyl ether (diosmetin 6,8-di-C-hexoside) 9.91 C28H32O16 623.1618 623.1646 3.5 2.1 567.1891, 381.1902
44 (epi)azfelechin glucoside derivative 10.03 C27H30O16 609.1402 609.1457 −3.2 12.7 435.1368, 273.0773
45 digalloylglucose isomer 10.03 C20H20O14 483.078 483.0931 −6.6 19.6 377.1008, 321.0748
46 digalloylglucose isomer 10.22 C20H20O14 483.078 483.0934 −6.7 15.7 377.1008, 321.0748
47 eriodictyol-O-hexoside 10.26 C21H22O11 449.1289 449.1235 −3.5 10 173.0162
48 (epi)azfelechin glucoside 10.38 C21H24O10 435.1297 435.1237 −3.2 8.7 273.0888
49 trihydroxy(iso)flavanol-(epi)catechin 10.78 C30H26O11 561.1402 561.1479 −3.6 6.5 449.1333, 289.1656
50 eriodictyol 11.08 C15H12O6 287.0561 287.0566 −3.4 9.3 -
51 daidzin 11.18 C21H20O9 415.1035 415.1068 −2.2 15.8 359.0897, 281.077
52 (epi)azfelechin glucoside 11.23 C21H24O10 435.1297 435.1236 −3.9 6.9 273.0867
53 (epi)azfelechin glucoside 11.32 C21H24O10 435.1297 435.1233 −3.3 5.6 273.1089
54 lucenin-2,4-methyl ether (diosmetin 6,8-di-C-hexoside) 11.40 C28H32O16 623.1618 623.1641 2.3 17.5 463.1415, 435.1502
55 trihydroxy(iso)flavanol-(epi)catechin 11.59 C30H26O11 561.1402 561.1467 −2.4 10.1 479.0994, 439.1923, 409.1001
56 baicalin 11.69 C21H18O11 445.0776 445.0716 −3.3 7.2 891.1876, 291.1229, 173.0167
57 trihydroxy(iso)flavanol-(epi)catechin 11.72 C30H26O11 561.1402 561.1476 −3.3 27.7 483.1149, 435.144, 313.0921
58 (epi)fisetinidol 11.85 C15H14O5 273.0768 273.0768 −3.3 7.8 149.0291, 123.0508
59 (epi)fisetinidol 12.00 C15H14O5 273.0768 273.0763 −3.6 13.4 173.0142, 149.0276, 123.0383
60 (epi)catechin-(epi)catechin 12.00 C30H26O12 577.1351 577.1335 −3.4 35.6 447.1115, 273.0863
61 (epi)azfelechin glucoside derivative 12.21 C27H30O16 609.1402 609.1444 −3.1 9.3 561.1585, 435.137, 273.0849
62 isorhamnetin-O-dihexoside 12.41 C28H32O17 639.1203 639.1273 −4.9 11.5 561.1618, 477.1199
63 rosmarinic acid 12.47 C18H16O8 359.0772 359.0795 −4.3 18.3 289.0587, 217.1178
64 (epi)azfelechin glucoside 12.74 C21H24O10 435.1297 435.1231 −3.9 7.2 273.0879
65 (epi)azfelechin glucoside 12.87 C21H24O10 435.1297 435.1235 −3.8 5.1 273.0877
66 trihydroxy(iso)flavanol-(epi)catechin 12.99 C30H26O11 561.1402 561.1483 −3.2 18.1 345.0787, 251.0658
67 trihydroxy(iso)flavanol-(epi)catechin 13.16 C30H26O11 561.1402 561.1478 −3.3 16.4 449.164, 435.1421
68 (epi)azfelechin glucoside 13.21 C21H24O10 435.1297 435.1234 −3.5 12.1 273.0846
69 syringic acid hexoside 13.24 C15H20O10 359.0984 359.0992 2.6 11.3 251.0642
70 phloretin dihexoside 13.60 C27H33O15 597.1825 597.1818 −3.3 6.3 477.1434, 387.2049
71 trihydroxy(iso)flavanol-(epi)catechin 14.03 C30H26O11 561.1402 561.1481 −3.8 19.6 447.1132, 413.1034
72 (epi)azfelechin-(epi)azfelechin -(epi)catechin 14.47 C45H38O16 833.2087 833.2046 −3.2 14.5 561.1625, 429.2246, 331.1875, 179.0626
73 diosmetin--rutinoside 14.65 C28H32O15 607.1668 607.1625 7.1 13.5 411.1149, 343.0861
74 trihydroxyflavanone dimer 14.67 C30H26O10 545.1453 545.1426 −3.7 16.1 447.1091, 431.2326, 173.0151
75 (epi)catechin-(epi)catechin 15.47 C30H24O12 575.1195 575.1188 −3.5 24.9 378.1656, 285.0525
76 durantin A 15.54 C22H20O9 427.1035 427.1048 −2.6 12.6 341.0792, 249.0385
77 diosmetin-rutinoside 16.12 C28H32O15 607.1668 607.1647 3.6 17.3 467.1121, 341.0817
78 2,6-dihydroxy-3-methyl-4-O-(6’’-O-galloyl-β-d-glucopyranosyl)-benzophenone 16.64 C27H26O13 557.1301 557.1256 7.9 16.4 521.276, 431.2423, 269.1844
79 caffeoylglucaric acid derivative 17.56 C24H52O14 563.3284 563.3261 4.2 12.9 547.2124, 471.2775
80 myricetin derivative 18.35 C30H60O20 739.3605 739.363 −3.4 19.8 565.3407, 489.2849
81 methylsyringin 18.47 C18H26O9 385.1504 385.1522 2.3 11.8 295.1442, 265.1188
82 (epi)azfelechin glucoside derivative 19.00 C27H52O12 567.3386 567.3376 −3.4 2.2 475.3059