Sample

Caffeine

Theobromine

Manually predominant compound

1

29.490

29.695

Caffeine

2

29.245

29.695

Theobromine

3

29.235

29.865

Theobromine

4

29.230

29.820

Theobromine

5

29.270

29.665

Theobromine

6

29.265

29.695

Theobromine

7

29.250

29.705

Theobromine

8

29.260

29.690

Theobromine

9

29.260

29.880

Theobromine

10

29.255

29.710

Theobromine

11

29.260

29.840

Theobromine

12

28.250

29.890

Theobromine

13

29.250

30.005

Theobromine

14

29.240

29.905

Theobromine

15

29.235

29.800

Theobromine

A

29.260

29.775

Uncertain

B

29.265

29.610

Uncertain

C

29.240

29.750

Theobromine

D

29.245

29.710

Theobromine

E

29.260

29.625

Theobromine

F

29.245

29.915

Theobromine