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. 2022 Jul 5;13:891762. doi: 10.3389/fphar.2022.891762

TABLE 1.

The list of identified in RC by LC-MS negative and positive mode analysis.

Putative Identification Molecular Formula Ion Mode Exact Mass Actual Mass Mass Error (ppm) RT (min) Intensity
Hydroxybenzoic acid C7H6O3 [M-H]- 137.0239 137.0223 1.6 2.12 26.1
Gentistic acid C7H6O4 [M-H]- 153.0188 153.017 1.8 1.58 62.7
O-coumaric acid C9H8O3 [M-H]- 163.0395 163.038 1.5 2.52 93.4
Gallic acid C7H6O5 [M-H]- 169.0137 169.0126 1.1 1.01 3003
Caffeic acid C9H8O4 [M-H]- 179.0344 179.0332 1.2 3.08 371
Quinic acid C7H12O6 [M-H]- 191.0556 191.0549 0.7 0.52 1064
Ethyl gallate C9H10O5 [M-H]- 197.045 197.0438 1.2 3.56 2150.9
Narigenin C15H12O5 [M-H]- 271.0606 271.058 2.6 6.55 20.3
Kaempferol C15H10O6 [M-H]- 285.0399 285.039 0.9 6.74 1208.3
Eriodictyol C15H12O6 [M-H]- 287.0556 287.0529 2.7 4.04 56.7
Ricinoleic acid C18H34O3 [M-H]- 297.243 297.2415 1.5 13.81 61.4
Ellagic acid C14H6O8 [M-H]- 300.9984 300.9984 0.0 3.68 12127.7
Quercetin C15H10O7 [M-H]- 301.0348 301.0339 0.9 5.8 2834.2
Isorhamnetin C16H12O7 [M-H]- 315.0505 315.0489 1.6 5.96 76.7
Protocatechuic acid 4-O-glucoside C13H16O9 [M-H]- 315.0716 315.0693 2.3 1.43 42.7
Myricetin C15H10O8 [M-H]- 317.0297 317.0283 1.4 4.23 173.9
Digallic acid C14H10O9 [M-H]- 321.0247 321.0213 3.4 3.48 26.9
Galloyl glucose C13H16O10 [M-H]- 331.0665 331.0657 0.8 0.57 3218.7
Chlorogenic acid C16H18O9 [M-H]- 353.0873 353.0834 3.9 2.33 7.7
Caffeoylquinic acid C16H18O9 [M-H]- 353.0873 353.0858 1.5 4.78 39.4
Apignin-7-glucoside C21H20O10 [M-H]- 431.0978 431.096 1.8 5.29 62
Naringenin 7-O-glucoside C21H22O10 [M-H]- 433.1135 433.1118 1.7 4.73 60.6
Kaempferol-3-glucoside C21H20O11 [M-H]- 447.0927 447.0922 0.5 4.46 22866.5
Isorhamnetin 3-O-glucoside C22H22O12 [M-H]- 477.1033 477.1003 3.0 3.64 99.1
Kaempferol 3-O-acetyl-glucoside C23H22O12 [M-H]- 489.1033 489.1001 3.2 5.23 225.9
Dicaffeoylquinic acid C25H24O12 [M-H]- 515.119 515.1173 1.7 4.78 258.1
Kaempferol 3-O-(6″-malonyl-glucoside) C24H22O14 [M-H]- 533.0931 533.0884 4.7 4.66 136.8
Kaempferol-3-rutinoside C27H30O15 [M-H]- 593.1506 593.1504 0.2 4.3 30266.7
Rutin C27H30O16 [M-H]- 609.1456 609.1453 0.3 3.84 50158.2
Coumarin C9H6O2 [M + H] + 147.0446 147.0419 2.7 2.53 50.2