Molecular Formula

Theoretical Mass

Experimental Mass

Mass Different (ppm)

Average Score

Species

Score (mass)

Score (Isotope Abundance)

Score (Isotope Spacing)

Number of compound found by molecular formula

Number of compound having structure correlate to degradation product

A1-CP1

C₃H₉N₄O

117.0782

117.0782

4.43

82.76

(M+H)+

96.28

99.09

36.12

0

0

A1-CP2

C₁₀H₁₅N₄O₂

223.1195

223.1195

0.07

86.70

(M+H)+

100

97.67

46.96

21

1

A1-CP3

C₁₄H₃₃N₄O

273.2658

273.2658

1.22

86.16

(M+H)+

99.11

94.73

49.98

0

0

A1-CP4

C₁₆H₃₃N₄

281.2704

281.2704

−0.47

86.37

(M+H)+

99.86

95.39

48.55

0

0