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Table 1 Characteristics of the frames retained for further analysis by applying the filter option

From: Identification and structural elucidation of ozonation transformation products of estrone

Frame number a

m/z

Retention time (min)

Normalized average intensities b

Average intensity in sample 1:8

Sample 1:0

Sample 1:1

Sample 1:5

9

275.12930

3.51

0.009

0.062

0.614

22664

78

317.14008

3.32

0.022

0.075

0.914

5323

200

212.09456

7.38

0.050

0.486

0.863

8552

225

224.06932

7.49

0.026

0.442

0.739

6080

241

202.07396

7.33

0.049

0.483

0.926

11688

267

224.09468

7.44

0.036

0.456

0.916

7829

282

228.08983

7.40

0.039

0.297

0.694

6061

294

226.07419

7.46

0.000

0.456

0.943

6511

333

226.08574

7.40

0.000

0.417

0.652

6489

344

229.08455

7.41

0.049

0.334

0.540

5285

357

212.05852

7.46

0.041

0.466

0.784

5656

358

201.07838

7.45

0.041

0.477

0.869

7736

375

215.06937

7.46

0.044

0.451

0.566

5559

418

250.14478

4.29

0.038

0.071

0.239

9056

419

250.14525

3.70

0.027

0.086

0.303

8340

574

250.14519

2.99

0.038

0.051

0.240

8590

  1. a Frame number is assigned sequentially by the software according to absolute intensity in all samples. Therefore frame #1 represents the most intense frame found across all samples. b Average intensity of each frame was normalized to its average intensity in the samples to the control (sample 1:8).