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. 2024 Jul 3;11:1390223. doi: 10.3389/fnut.2024.1390223

Table 2.

Masses, retention times, and annotations of labeled-compounds.

Study Retention time m/z Adduct Neutral mass Identification
Broccoli Urine 23 426.1023 [M-H + FA]- 381.105 Predicted: Glucuronidated Compound
404.0952 [M + Na]+
21.18 366.0817 [M-H]- 367.0892 Predicted: indole-3-acetic acid-N-O-glucuronide
390.0787 [M + Na]+
20.7 510.1234 [M-H]- 511.1314 Predicted: Glucuronidated Compound
512.1394 [M + H]+
Collard Greens Urine 20 225.0765 [M-H]- 226.0835 Predicted: Dihydrosinapic Acid
227.0907 [M + H]+
249.0727 [M + Na]+
21.17 304.2494 [M +?]+ Predicted: No MS/MS Captured
17.79 250.0728 [M +?]- Predicted: N-Acyl-Alpha Amino Acids
15.91 251.0138 [M +?]- Predicted: Aminopyrimidines
18.97 289.0394 [M +?]- Predicted: Sulfuric Acid Monoesters
Collard Greens Plasma 6.36 130.0867 [M-H]+ 131.0939 Isoleucine
132.1011 [M + H]+
24.8 311.2229 [M-H]+ 312.2291 Predicted: Linoleic Acids and Derivatives
295.2247 [M + H-H2O]+
24.8 313.2372 [M-H]+ 314.2426 No MS/MS Captured
297.2375 [M + H-H2O]+
24.8 333.2044 [M-H]- 334.2113 Predicted: Alkaloids
335.2181 [M + H]+
24.8 335.2199 [M-H]- 336.2254 No MS/MS Captured
403.2071 [M-H + HCOONa]-
337.2327 [M + H]+