Peak | Retention time (min) | Experimental [M−H]− (m/z) | Theoretical [M−H]− (m/z) | Delta (ppm) | Main MS2 fragments | UV max. (nm) | Molecular formula | Proposed compound |
---|---|---|---|---|---|---|---|---|
1 | 15.26 | 431.09823 | 431.09837 | − 0.325 | 369.18481, 329.13257, 269.13925, 203.05310 | 260 | C21H20O10 | Genistin |
2 | 19.31 | 415.10405 | 415.10346 | 1.421 | 253.10510 | 255 | C21H20O9 | Daidzin |
3 | 20.19 | 563.14050 | 563.14063 | − 0.228 | 503.28558, 473.20331, 443.26880, 383.15466, 353.13293 | 273, 334 | C26H28O14 | Isoschaftoside |
4 | 29.46 | 253.05037 | 253.05063 | − 1.036 | 224.17744, 209.02998, 197.07283, 134.95865 | 250, 303 | C15H10O4 | Daidzein |
5 | 30.30 | 283.06104 | 283.06120 | − 0.554 | 268.09027 | 255 | C16H12O5 | Glycitein |
6 | 32.58 | 269.04538 | 269.04555 | − 0.619 | 241.05565, 225.15002, 181.10497 | 261 | C15H10O5 | Genistein |