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. 2020 Jun 26;25(12):2942. doi: 10.3390/molecules25122942

Table 1.

TraceFinderTM bioactive compound profiling report obtained for a selected turmeric (Biospirit brand) sample.

Target Name +/− Area Formula Expected m/z Measured m/z Error
(ppm)		 Isotopic Pattern Score (%)
Polyphenolic accurate mass database
D-(-)-Quinic acid − 2.37 × 106 C7H12O6 191.0561 191.0565 2.19 100
Syringic acid − 1.92 × 105 C7H12O6 197.0455 197.0460 2.80 100
2,5-Dihydroxybenzoic acid − 7.57 × 105 C9H10O5 153.0193 153.0193 0.21 100
Caffeic acid − 4.34 × 105 C9H10O5 179.0350 179.0353 1.90 100
Homovanillic acid − 6.09 × 105 C7H6O4 181.0506 181.0510 2.27 100
4-Hydroxybenzoic acid − 3.82 × 106 C9H10O4 137.0244 137.0244 0.55 100
Homogentisic acid − 2.10 × 106 C7H6O3 167.0349 167.0351 1.06 100
Ellagic acid − 3.26 × 105 C8H8O4 300.9990 300.9996 2.00 93
p-coumaric acid − 4.32 × 106 C8H8O4 163.0401 163.0401 0.37 100
Ferulic acid − 1.05 × 106 C14H6O8 193.0506 193.0510 2.28 100
Vanillin − 6.59 × 105 C9H8O3 151.0401 151.0402 1.11 100
trans-Cinnamic acid − 2.92 × 105 C10H10O4 147.0452 147.0454 1.53 100
Rosmanol − 1.05 × 106 C8H8O3 345.1707 345.1711 1.28 100
Quercetin − 1.56 × 105 C20H26O5 301.0354 301.0357 1.22 91
Homoplantaginin − 1.78 × 107 C15H10O7 461.1089 461.1071 −3.74 83
Umbelliferon − 1.11 × 105 C15H10O7 161.0244 161.0242 −1.24 100
Carnosol − 2.36 × 105 C22H22O11 329.1758 329.1763 1.52 78
Curcuminoid accurate mass database
1 − 9.80 × 106 C19H18O5 325.1081 325.1085 1.33 100
N1 − 1.36 × 106 C19H16O6 339.0874 339.0877 0.97 100
8 − 3.61 × 107 C19H16O3 291.1026 291.1030 1.33 100
6 − 6.30 × 105 C21H22O7 385.1292 385.1296 1.01 85
N11 − 1.43 × 108 C20H18O4 321.1132 321.1135 1.01 100
5 − 2.62 × 107 C19H16O5 323.0925 323.0928 0.94 100
N7 − 2.51 × 107 C21H20O5 351.1238 351.1240 0.72 100
10 − 1.78 × 107 C20H18O6 353.1030 353.1032 0.43 100
9 − 6.53 × 107 C19H18O4 309.1132 309.1135 1.15 100
N2 − 1.78 × 107 C20H20O5 339.1238 339.1241 0.93 100
bdmc − 1.40 × 109 C19H16O4 307.0975 307.0979 1.34 100
N3 − 3.29 × 107 C21H22O6 369.1343 369.1346 0.77 100
dmc − 1.44 × 109 C20H18O5 337.1081 337.1087 1.82 100
curcumin − 1.65 × 109 C21H20O6 367.1187 367.1192 1.34 100