Table 1.
No. | tR/min | Positive Ion Mode | Negative Ion Mode | Compound | ||||
---|---|---|---|---|---|---|---|---|
Molecular Ion (m/z) | Molecular Formula | Error (ppm) | Molecular Ion (m/z) | Molecular Formula | Error (ppm) | |||
1 | 2.391 | [M + Na]+ 377.0855 | C16H18O9 | 1.591 | [M − H]− 353.0879 | C16H18O9 | 1.699 | Chlorogenic acid |
2 | 5.159 | [M + Na]+ 203.0021 | C9H8O4 | −6.206 | [M − H]− 179.0430 | C9H8O4 | 4.934 | Caffeic acid |
3 | 7.526 | [M + Na]+ 539.1169 | C25H24O12 | −0.557 | [M − H]− 515.1195 | C25H24O12 | 0.971 | Isochlorogenic acid B |
4 | 7.806 | [M + Na]+ 539.1169 | C25H24O12 | 0.742 | [M − H]− 515.1198 | C25H24O12 | 1.553 | Isochlorogenic acid A |
5 | 9.820 | [M + Na]+ 539.1169 | C25H24O12 | −0.371 | [M − H]− 515.1197 | C25H24O12 | 1.359 | Isochlorogenic acid C |
6 | 25.948 | [M + Na]+ 307.9490 | C17H16O4 | 0.977 | [M − H]− 283.0969 | C17H16O4 | −0.353 | caffeic acid phenethyl ester |
7 | 33.078 | [M + Na]+ 323.1618 | C19H24O3 | −1.547 | [M − H]− 299.1649 | C19H24O3 | 0.669 | Artepillin C |