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. 2021 Jan 25;11:625108. doi: 10.3389/fphar.2020.625108

TABLE 4.

MS date for characterization of compounds in ZZCD.

NO. Formula tR(min) Molecular weight MS(+) MS(-) Compound identification
1 C16H22O11 3.366 390.1189 389.1114[M-H]- Deacetylasperulosidic acid
2 C16H22O10 3.962 374.1222 357.118[M + H-H2O]+ 373.1154[M-H]- Gardoside
3 C16H24O11 3.962 392.133 373.1153[M-H-H2O]- Shanzhiside
4 C16H18O9 4.194 354.0961 353.0882[M-H]- 3-O-Caffeoylquinic acid
5 C18H26O13 4.284 450.1389 449.1318[M-H]- Gardenoside
6 C23H22O11 4.284 474.1141 501.1014[M + HCOO-H2O]- 6″-O-Acetylgenistin
7 C24H22O12 4.301 502.1096 501.1014[M-H]- Malonyldaidzin
8 C23H34O15 4.905 550.1909 573.1827[M + Na]+ 549.1831[M-H]- Genipin-1-β-D-gentiobioside
9 C17H24O10 5.26 388.1344 433.1313[M + HCOO]- Geniposide
10 C17H26O11 5.26 406.145 433.1313[M + HCOO-H2O]- Shanzhiside methylester
11 C11H14O5 5.269 226.0843 227.0924[M + H]+ 225.0766[M-H]- Genipin
12 C17H26O10 5.442 390.1508 435.1513[M + HCOO]- Loganin
13 C21H20O9 5.575 416.1117 417.1191[M + H]+ 461.1103[M + HCOO]- Daidzin
14 C16H26O7 5.616 330.1686 331.1782[M + H]+ 375.1665[M + HCOO]- Jasminoside A
15 C22H22O10 5.658 446.1199 447.1313[M + H]+ 491.1189[M + HCOO]- Glycitin
16 C9H8O3 5.798 164.0477 147.0443[M + H-H2O]+ 163.0403[M-H]- P-coumaric acid
17 C16H26O8 5.864 346.1624 329.1595[M + H-H2O]+ 373.1499[M + HCOO-H2O]- Jasminoside B
18 C21H20O10 6.22 432.109 433.1163[M + H]+ 477.1058[M + HCOO]- Genistin
19 C24H22O13 6.22 518.1041 545.0922[M + HCOO-H2O]- Malonylgenistin
20 C22H36O12 6.824 492.2216 510.2564[M + NH4]+ 537.2215[M + HCOO]- Jasminoside I
21 C21H34O11 7.204 462.2116 485.203[M + Na]+ 507.21[M + HCOO]- Jasminoside T
22 C15H10O4 7.353 254.0573 255.0668[M + H]+ 253.0502[M-H]- Daidzein
23 C16H12O5 7.516 284.0698 285.0759[M + H]+ Glycitein
24 C32H44O14 8.627 652.2735 675.2654[M + Na]+ 697.2723[M + HCOO]- beta-d-gentiobiosyl crocetin
25 C10H16O3 9.09 184.1101 167.1072[M + H-H2O]+ 165.0928[M-H-H2O]- Jasminodiol