Table 2. Comparison of the Adulterations Markers Detected in Negative Ionization Mode.
| Laboratory #1 |
Laboratory #2 |
|||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| compound ID | formula | m/z [M – H]− | Δmass (ppm) | RT [min] | p-value DEA | p-value DEO | p-value DEO_DEA | formula | m/z [M – H]− | Δmass (ppm) | RT [min] | p-value DEA | p-value DEO | p-value DEO_DEA |
| 7 | C23H29ClO4 | 403.1682 | 1.5 | 5.67 | 2.03 × 10–10 | 1.00 × 10–15 | 1.17 × 10–8 | C23H29ClO4 | 403.1663 | 3.2 | 3.74 | 5.19 × 10–37 | 1.52 × 10–37 | 1.22 × 10–20 |
| 8 | C23H27ClO4 | 401.1534 | 3.7 | 5.60 | 1.00 × 10–15 | 1.00 × 10–15 | 1.09 × 10–5 | C23H27ClO4 | 401.151 | 2.2 | 3.67 | 7.33 × 10–56 | 7.16 × 10–43 | n.a. |
| 9 | C25H33ClO6 | 463.1903 | 3.5 | 5.35 | 9.10 × 10–10 | 1.00 × 10–15 | 1.07 × 10–7 | C25H33ClO6 | 463.182 | 14.5 | 3.49 | 2.70 × 10–24 | 2.26 × 10–22 | 1.04 × 10–19 |
| 10 | C25H31ClO6 | 461.1748 | 3.9 | 5.41 | 1.00 × 10–15 | 1.00 × 10–15 | 1.00 × 10–15 | C25H31ClO6 | 461.1723 | 1.5 | 3.53 | 4.33 × 10–21 | 2.67 × 10–13 | 6.85 × 10–24 |
| 11 | C23H33ClO5 | 423.1955 | 4.0 | 5.40 | 1.00 × 10–15 | 1.00 × 10–15 | 1.00 × 10–15 | C23H33ClO5 | 423.1927 | 2.6 | 3.52 | 2.06 × 10–42 | 2.75 × 10–50 | 2.69 × 10–24 |
| 12 | C23H32O4 | 371.2231 | 2.4 | 5.50 | 1.29 × 10–5 | 3.34 × 10–9 | 8.05 × 10–6 | C23H32O4 | 371.222 | 0.5 | 3.58 | 3.59 × 10–26 | 4.23 × 10–28 | 1.21 × 10–15 |