TABLE 3

LC/MS of products of MPO/H2O2 oxidation of 3-OH-CBZ


Compound or Possible Structure

Retention Time

Molecular Ion (MH+)

Fragment Pattern m/z (Percentage of Intensity)
min
3-OH-CBZ dimer 9.1 503 (CC1) 503.2 (20%), 460.1 (100%), 443.6 (25%), 417.1 (20%), 414.7 (20%)
12.1 503 (CC2) 503.4 (90%), 486.2 (20%), 485.4 (30%), 469.0 (50%), 460.5 (100%), 443.4 (100%), 441.4 (75%), 417.0 (25%), 414.9 (30%), 213.1 (25%)
13.9 503 (CC3) 503.0 (100%), 486.1 (25%), 459.9 (75%), 457.9 (75%), 442.8 (30%), 415.3 (25%), 386.8 (25%), 208.6 (50%)
3-OH-CBZ NATyr cross dimer 9.0 474 (CY1) 474.0 (50%), 456.2 (10%), 429.2 (100%), 386.5 (35%), 343.3 (15%), 341.4 (15%)

9.6
474 (CY2)
474.2 (75%), 431.2 (40%), 428.8 (40%), 386.4 (100%), 369.1 (25%), 341.4 (20%)