Record Index Results

LC-ESI-FT-MS; NEG

LC-ESI-IT-MS/MS; m/z:194.93; NEG

LC-ESI-IT-MS/MS; m/z:275.02; NEG

LC-ESI-IT-MS/MS; m/z:372.98; NEG

mass calculator

user manual

Notice: Fac. Med, Univ. Tokyo server is temporarily unavailable.

Index Type :

    Contributor: Grad Sch Info Sci, NAIST Edit / Resubmit Query

Results : 827 Hit.  ( 1 - 241 Displayed )

First Prev 1 2 3 Next Last    ( Total 3 Page )   ▼ Results End

Name       Formula / Structure       ExactMass      ID


    (S)-Malate
3 spectra
C4H6O5    134.02152

    LC-ESI-FT-MS; NEG                 KNA00527

    LC-ESI-IT-MS/MS; m/z:1265.98; NEG                 KNA00528

    LC-ESI-IT-MS/MS; m/z:133.01; NEG                 KNA00529


    2-Oxoglutarate
8 spectra
C5H6O5    146.02152

    LC-ESI-FT-MS; NEG                 KNA00700

    LC-ESI-FT-MS; NEG                 KNA00530

    LC-ESI-IT-MS/MS; m/z:101.02; NEG                 KNA00531

    LC-ESI-IT-MS/MS; m/z:101.02; NEG                 KNA00701

    LC-ESI-IT-MS/MS; m/z:133.01; NEG                 KNA00532

    LC-ESI-IT-MS/MS; m/z:145.01; NEG                 KNA00702

    LC-ESI-IT-MS/MS; m/z:145.01; NEG                 KNA00533

    LC-ESI-IT-MS/MS; m/z:383.11; NEG                 KNA00703


    3',5'-Cyclic AMP
16 spectra
C10H12N5O6P    329.05252

    LC-ESI-FT-MS; NEG                 KNA00592

    LC-ESI-FT-MS; NEG                 KNA00796

    LC-ESI-FT-MS; POS                 KNA00193

    LC-ESI-FT-MS; POS                 KNA00427

    LC-ESI-IT-MS/MS; m/z:134.05; NEG                 KNA00797

    LC-ESI-IT-MS/MS; m/z:134.05; NEG                 KNA00593

    LC-ESI-IT-MS/MS; m/z:284.10; POS                 KNA00194

    LC-ESI-IT-MS/MS; m/z:328.04; NEG                 KNA00798

    LC-ESI-IT-MS/MS; m/z:328.04; NEG                 KNA00594

    LC-ESI-IT-MS/MS; m/z:330.06; POS                 KNA00428

    LC-ESI-IT-MS/MS; m/z:330.06; POS                 KNA00195

    LC-ESI-IT-MS/MS; m/z:331.06; POS                 KNA00196

    LC-ESI-IT-MS/MS; m/z:331.06; POS                 KNA00429

    LC-ESI-IT-MS/MS; m/z:657.10; NEG                 KNA00799

    LC-ESI-IT-MS/MS; m/z:657.10; NEG                 KNA00595

    LC-ESI-IT-MS/MS; m/z:659.11; POS                 KNA00430


    3,4-Dihydroxy-L-phenylalanine
16 spectra
C9H11NO4    197.06881

    LC-ESI-FT-MS; NEG                 KNA00576

    LC-ESI-FT-MS; NEG                 KNA00684

    LC-ESI-FT-MS; POS                 KNA00284

    LC-ESI-FT-MS; POS                 KNA00173

    LC-ESI-IT-MS/MS; m/z:152.06; POS                 KNA00174

    LC-ESI-IT-MS/MS; m/z:196.06; NEG                 KNA00577

    LC-ESI-IT-MS/MS; m/z:196.06; NEG                 KNA00685

    LC-ESI-IT-MS/MS; m/z:198.08; POS                 KNA00175

    LC-ESI-IT-MS/MS; m/z:198.08; POS                 KNA00285

    LC-ESI-IT-MS/MS; m/z:244.09; POS                 KNA00286

    LC-ESI-IT-MS/MS; m/z:284.10; POS                 KNA00176

    LC-ESI-IT-MS/MS; m/z:346.06; NEG                 KNA00578

    LC-ESI-IT-MS/MS; m/z:393.13; NEG                 KNA00579

    LC-ESI-IT-MS/MS; m/z:487.18; POS                 KNA00287

    LC-ESI-IT-MS/MS; m/z:540.05; NEG                 KNA00686

    LC-ESI-IT-MS/MS; m/z:662.10; NEG                 KNA00687


    3-Phospho-D-glycerate
8 spectra
C3H7O7P    185.99294

    LC-ESI-FT-MS; NEG                 KNA00820

    LC-ESI-FT-MS; POS                 KNA00467

    LC-ESI-IT-MS/MS; m/z:1105.97; NEG                 KNA00821

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00468

    LC-ESI-IT-MS/MS; m/z:184.99; NEG                 KNA00822

    LC-ESI-IT-MS/MS; m/z:187.00; POS                 KNA00469

    LC-ESI-IT-MS/MS; m/z:370.98; NEG                 KNA00823

    LC-ESI-IT-MS/MS; m/z:391.28; POS                 KNA00470


    3-Sulfino-L-alanine
16 spectra
C3H7NO4S    153.00958

    LC-ESI-FT-MS; NEG                 KNA00534

    LC-ESI-FT-MS; NEG                 KNA00720

    LC-ESI-FT-MS; POS                 KNA00332

    LC-ESI-FT-MS; POS                 KNA00129

    LC-ESI-IT-MS/MS; m/z:152.00; NEG                 KNA00721

    LC-ESI-IT-MS/MS; m/z:152.00; NEG                 KNA00535

    LC-ESI-IT-MS/MS; m/z:154.02; POS                 KNA00333

    LC-ESI-IT-MS/MS; m/z:154.02; POS                 KNA00130

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00334

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00131

    LC-ESI-IT-MS/MS; m/z:259.02; NEG                 KNA00722

    LC-ESI-IT-MS/MS; m/z:261.04; POS                 KNA00335

    LC-ESI-IT-MS/MS; m/z:391.28; POS                 KNA00132

    LC-ESI-IT-MS/MS; m/z:418.90; NEG                 KNA00536

    LC-ESI-IT-MS/MS; m/z:519.05; NEG                 KNA00723

    LC-ESI-IT-MS/MS; m/z:571.90; NEG                 KNA00537


    4-Aminobutanoate
8 spectra
C4H9NO2    103.06333

    LC-ESI-FT-MS; POS                 KNA00316

    LC-ESI-FT-MS; POS                 KNA00005

    LC-ESI-IT-MS/MS; m/z:104.07; POS                 KNA00317

    LC-ESI-IT-MS/MS; m/z:104.07; POS                 KNA00006

    LC-ESI-IT-MS/MS; m/z:105.07; POS                 KNA00007

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00318

    LC-ESI-IT-MS/MS; m/z:229.08; POS                 KNA00008

    LC-ESI-IT-MS/MS; m/z:494.35; POS                 KNA00319


    4-Hydroxy-L-proline
12 spectra
C5H9NO3    131.05824

    LC-ESI-FT-MS; NEG                 KNA00696

    LC-ESI-FT-MS; POS                 KNA00296

    LC-ESI-FT-MS; POS                 KNA00037

    LC-ESI-IT-MS/MS; m/z:120.07; POS                 KNA00038

    LC-ESI-IT-MS/MS; m/z:126.02; POS                 KNA00039

    LC-ESI-IT-MS/MS; m/z:130.05; NEG                 KNA00697

    LC-ESI-IT-MS/MS; m/z:132.07; POS                 KNA00040

    LC-ESI-IT-MS/MS; m/z:132.07; POS                 KNA00297

    LC-ESI-IT-MS/MS; m/z:133.07; POS                 KNA00298

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00299

    LC-ESI-IT-MS/MS; m/z:261.11; NEG                 KNA00698

    LC-ESI-IT-MS/MS; m/z:446.09; NEG                 KNA00699


    6-Phospho-D-gluconate
4 spectra
C6H13O10P    276.02463

    LC-ESI-FT-MS; NEG                 KNA00748

    LC-ESI-IT-MS/MS; m/z:194.93; NEG                 KNA00749

    LC-ESI-IT-MS/MS; m/z:275.02; NEG                 KNA00750

    LC-ESI-IT-MS/MS; m/z:372.98; NEG                 KNA00751


    ADP
4 spectra
C10H15N5O10P2    427.02941

    LC-ESI-FT-MS; NEG                 KNA00824

    LC-ESI-IT-MS/MS; m/z:426.02; NEG                 KNA00825

    LC-ESI-IT-MS/MS; m/z:513.95; NEG                 KNA00826

    LC-ESI-IT-MS/MS; m/z:551.92; NEG                 KNA00827


    AMP
16 spectra
C10H14N5O7P    347.06308

    LC-ESI-FT-MS; NEG                 KNA00816

    LC-ESI-FT-MS; NEG                 KNA00596

    LC-ESI-FT-MS; POS                 KNA00197

    LC-ESI-FT-MS; POS                 KNA00447

    LC-ESI-IT-MS/MS; m/z:1040.18; NEG                 KNA00817

    LC-ESI-IT-MS/MS; m/z:136.06; POS                 KNA00448

    LC-ESI-IT-MS/MS; m/z:307.08; POS                 KNA00198

    LC-ESI-IT-MS/MS; m/z:346.05; NEG                 KNA00818

    LC-ESI-IT-MS/MS; m/z:346.06; NEG                 KNA00597

    LC-ESI-IT-MS/MS; m/z:348.07; POS                 KNA00449

    LC-ESI-IT-MS/MS; m/z:348.07; POS                 KNA00199

    LC-ESI-IT-MS/MS; m/z:349.07; POS                 KNA00450

    LC-ESI-IT-MS/MS; m/z:611.15; NEG                 KNA00598

    LC-ESI-IT-MS/MS; m/z:613.16; POS                 KNA00200

    LC-ESI-IT-MS/MS; m/z:693.12; NEG                 KNA00599

    LC-ESI-IT-MS/MS; m/z:693.12; NEG                 KNA00819


    Acetyl-CoA
8 spectra
C23H38N7O17P3S    809.12577

    LC-ESI-FT-MS; NEG                 KNA00604

    LC-ESI-FT-MS; POS                 KNA00205

    LC-ESI-IT-MS/MS; m/z:134.05; NEG                 KNA00605

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00206

    LC-ESI-IT-MS/MS; m/z:405.57; POS                 KNA00207

    LC-ESI-IT-MS/MS; m/z:808.12; NEG                 KNA00606

    LC-ESI-IT-MS/MS; m/z:809.12; NEG                 KNA00607

    LC-ESI-IT-MS/MS; m/z:810.13; POS                 KNA00208


    Adenine
11 spectra
C5H5N5    135.05450

    LC-ESI-FT-MS; NEG                 KNA00566

    LC-ESI-FT-MS; POS                 KNA00157

    LC-ESI-FT-MS; POS                 KNA00443

    LC-ESI-IT-MS/MS; m/z:134.05; NEG                 KNA00567

    LC-ESI-IT-MS/MS; m/z:135.03; NEG                 KNA00568

    LC-ESI-IT-MS/MS; m/z:136.06; POS                 KNA00158

    LC-ESI-IT-MS/MS; m/z:136.06; POS                 KNA00444

    LC-ESI-IT-MS/MS; m/z:137.05; POS                 KNA00159

    LC-ESI-IT-MS/MS; m/z:137.06; POS                 KNA00160

    LC-ESI-IT-MS/MS; m/z:137.06; POS                 KNA00445

    LC-ESI-IT-MS/MS; m/z:348.07; POS                 KNA00446


    Adenosine
8 spectra
C10H13N5O4    267.09675

    LC-ESI-FT-MS; POS                 KNA00117

    LC-ESI-FT-MS; POS                 KNA00304

    LC-ESI-IT-MS/MS; m/z:193.07; POS                 KNA00305

    LC-ESI-IT-MS/MS; m/z:268.10; POS                 KNA00118

    LC-ESI-IT-MS/MS; m/z:268.10; POS                 KNA00306

    LC-ESI-IT-MS/MS; m/z:269.11; POS                 KNA00119

    LC-ESI-IT-MS/MS; m/z:308.09; POS                 KNA00120

    LC-ESI-IT-MS/MS; m/z:385.13; POS                 KNA00307


    Anthranilate
8 spectra
C7H7NO2    137.04768

    LC-ESI-FT-MS; POS                 KNA00435

    LC-ESI-FT-MS; POS                 KNA00057

    LC-ESI-IT-MS/MS; m/z:120.04; POS                 KNA00436

    LC-ESI-IT-MS/MS; m/z:120.04; POS                 KNA00058

    LC-ESI-IT-MS/MS; m/z:138.05; POS                 KNA00059

    LC-ESI-IT-MS/MS; m/z:138.06; POS                 KNA00437

    LC-ESI-IT-MS/MS; m/z:139.06; POS                 KNA00438

    LC-ESI-IT-MS/MS; m/z:139.06; POS                 KNA00060


    CDP
8 spectra
C9H15N3O11P2    403.01818

    LC-ESI-FT-MS; NEG                 KNA00800

    LC-ESI-FT-MS; POS                 KNA00213

    LC-ESI-IT-MS/MS; m/z:158.93; NEG                 KNA00801

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00214

    LC-ESI-IT-MS/MS; m/z:384.00; NEG                 KNA00802

    LC-ESI-IT-MS/MS; m/z:391.28; POS                 KNA00215

    LC-ESI-IT-MS/MS; m/z:402.01; NEG                 KNA00803

    LC-ESI-IT-MS/MS; m/z:404.02; POS                 KNA00216


    Carnosine
16 spectra
C9H14N4O3    226.10659

    LC-ESI-FT-MS; NEG                 KNA00652

    LC-ESI-FT-MS; NEG                 KNA00511

    LC-ESI-FT-MS; POS                 KNA00109

    LC-ESI-FT-MS; POS                 KNA00260

    LC-ESI-IT-MS/MS; m/z:110.07; NEG                 KNA00512

    LC-ESI-IT-MS/MS; m/z:114.06; POS                 KNA00110

    LC-ESI-IT-MS/MS; m/z:114.06; POS                 KNA00261

    LC-ESI-IT-MS/MS; m/z:147.11; POS                 KNA00262

    LC-ESI-IT-MS/MS; m/z:156.08; POS                 KNA00111

    LC-ESI-IT-MS/MS; m/z:225.10; NEG                 KNA00513

    LC-ESI-IT-MS/MS; m/z:225.10; NEG                 KNA00653

    LC-ESI-IT-MS/MS; m/z:227.11; POS                 KNA00112

    LC-ESI-IT-MS/MS; m/z:227.11; POS                 KNA00263

    LC-ESI-IT-MS/MS; m/z:293.09; NEG                 KNA00654

    LC-ESI-IT-MS/MS; m/z:451.21; NEG                 KNA00514

    LC-ESI-IT-MS/MS; m/z:473.19; NEG                 KNA00655


    Citrate
8 spectra
C6H8O7    192.02700

    LC-ESI-FT-MS; NEG                 KNA00812

    LC-ESI-FT-MS; NEG                 KNA00550

    LC-ESI-IT-MS/MS; m/z:111.01; NEG                 KNA00813

    LC-ESI-IT-MS/MS; m/z:111.01; NEG                 KNA00551

    LC-ESI-IT-MS/MS; m/z:191.02; NEG                 KNA00814

    LC-ESI-IT-MS/MS; m/z:191.02; NEG                 KNA00552

    LC-ESI-IT-MS/MS; m/z:346.06; NEG                 KNA00815

    LC-ESI-IT-MS/MS; m/z:435.96; NEG                 KNA00553


    Creatine
16 spectra
C4H9N3O2    131.06948

    LC-ESI-FT-MS; NEG                 KNA00772

    LC-ESI-FT-MS; NEG                 KNA00558

    LC-ESI-FT-MS; POS                 KNA00149

    LC-ESI-FT-MS; POS                 KNA00392

    LC-ESI-IT-MS/MS; m/z:122.03; POS                 KNA00150

    LC-ESI-IT-MS/MS; m/z:130.06; NEG                 KNA00559

    LC-ESI-IT-MS/MS; m/z:130.06; NEG                 KNA00773

    LC-ESI-IT-MS/MS; m/z:132.08; POS                 KNA00151

    LC-ESI-IT-MS/MS; m/z:132.08; POS                 KNA00393

    LC-ESI-IT-MS/MS; m/z:133.08; POS                 KNA00394

    LC-ESI-IT-MS/MS; m/z:261.13; NEG                 KNA00560

    LC-ESI-IT-MS/MS; m/z:261.13; NEG                 KNA00774

    LC-ESI-IT-MS/MS; m/z:263.15; POS                 KNA00152

    LC-ESI-IT-MS/MS; m/z:263.15; POS                 KNA00395

    LC-ESI-IT-MS/MS; m/z:392.20; NEG                 KNA00775

    LC-ESI-IT-MS/MS; m/z:392.20; NEG                 KNA00561


    Cytidine
15 spectra
C9H13N3O5    243.08552

    LC-ESI-FT-MS; NEG                 KNA00620

    LC-ESI-FT-MS; NEG                 KNA00692

    LC-ESI-FT-MS; POS                 KNA00292

    LC-ESI-FT-MS; POS                 KNA00225

    LC-ESI-IT-MS/MS; m/z:112.05; POS                 KNA00226

    LC-ESI-IT-MS/MS; m/z:198.08; POS                 KNA00293

    LC-ESI-IT-MS/MS; m/z:242.08; NEG                 KNA00621

    LC-ESI-IT-MS/MS; m/z:242.08; NEG                 KNA00693

    LC-ESI-IT-MS/MS; m/z:244.09; POS                 KNA00294

    LC-ESI-IT-MS/MS; m/z:244.09; POS                 KNA00227

    LC-ESI-IT-MS/MS; m/z:288.08; NEG                 KNA00622

    LC-ESI-IT-MS/MS; m/z:288.08; NEG                 KNA00694

    LC-ESI-IT-MS/MS; m/z:487.18; POS                 KNA00295

    LC-ESI-IT-MS/MS; m/z:531.17; NEG                 KNA00623

    LC-ESI-IT-MS/MS; m/z:540.05; NEG                 KNA00695


    Cytosine
8 spectra
C4H5N3O    111.04326

    LC-ESI-FT-MS; POS                 KNA00017

    LC-ESI-FT-MS; POS                 KNA00431

    LC-ESI-IT-MS/MS; m/z:112.05; POS                 KNA00018

    LC-ESI-IT-MS/MS; m/z:112.05; POS                 KNA00432

    LC-ESI-IT-MS/MS; m/z:158.00; POS                 KNA00433

    LC-ESI-IT-MS/MS; m/z:223.09; POS                 KNA00434

    LC-ESI-IT-MS/MS; m/z:223.09; POS                 KNA00019

    LC-ESI-IT-MS/MS; m/z:224.10; POS                 KNA00020


    D-2-Aminobutyrate
8 spectra
C4H9NO2    103.06333

    LC-ESI-FT-MS; POS                 KNA00348

    LC-ESI-FT-MS; POS                 KNA00001

    LC-ESI-IT-MS/MS; m/z:104.07; POS                 KNA00349

    LC-ESI-IT-MS/MS; m/z:104.07; POS                 KNA00002

    LC-ESI-IT-MS/MS; m/z:106.05; POS                 KNA00003

    LC-ESI-IT-MS/MS; m/z:122.03; POS                 KNA00350

    LC-ESI-IT-MS/MS; m/z:171.15; POS                 KNA00351

    LC-ESI-IT-MS/MS; m/z:207.13; POS                 KNA00004


    D-Gluconic acid
8 spectra
C6H12O7    196.05830

    LC-ESI-FT-MS; NEG                 KNA00636

    LC-ESI-FT-MS; NEG                 KNA00546

    LC-ESI-IT-MS/MS; m/z:150.04; NEG                 KNA00637

    LC-ESI-IT-MS/MS; m/z:151.03; NEG                 KNA00547

    LC-ESI-IT-MS/MS; m/z:195.05; NEG                 KNA00638

    LC-ESI-IT-MS/MS; m/z:195.05; NEG                 KNA00548

    LC-ESI-IT-MS/MS; m/z:301.09; NEG                 KNA00639

    LC-ESI-IT-MS/MS; m/z:513.95; NEG                 KNA00549


    D-Glucose 1-phosphate
4 spectra
C6H13O9P    260.02972

    LC-ESI-FT-MS; NEG                 KNA00680

    LC-ESI-IT-MS/MS; m/z:259.02; NEG                 KNA00681

    LC-ESI-IT-MS/MS; m/z:519.05; NEG                 KNA00682

    LC-ESI-IT-MS/MS; m/z:540.05; NEG                 KNA00683


    D-Ribose 5-phosphate
4 spectra
C5H11O8P    230.01915

    LC-ESI-FT-MS; NEG                 KNA00656

    LC-ESI-IT-MS/MS; m/z:229.01; NEG                 KNA00657

    LC-ESI-IT-MS/MS; m/z:459.03; NEG                 KNA00658

    LC-ESI-IT-MS/MS; m/z:689.05; NEG                 KNA00659

First Prev 1 2 3 Next Last    ( Total 3 Page )   ▲ Results Top

		LC-ESI-FT-MS; NEG				KNA00527
		LC-ESI-IT-MS/MS; m/z:1265.98; NEG				KNA00528
		LC-ESI-IT-MS/MS; m/z:133.01; NEG				KNA00529

		LC-ESI-FT-MS; NEG				KNA00700
		LC-ESI-FT-MS; NEG				KNA00530
		LC-ESI-IT-MS/MS; m/z:101.02; NEG				KNA00531
		LC-ESI-IT-MS/MS; m/z:101.02; NEG				KNA00701
		LC-ESI-IT-MS/MS; m/z:133.01; NEG				KNA00532
		LC-ESI-IT-MS/MS; m/z:145.01; NEG				KNA00702
		LC-ESI-IT-MS/MS; m/z:145.01; NEG				KNA00533
		LC-ESI-IT-MS/MS; m/z:383.11; NEG				KNA00703

		LC-ESI-FT-MS; NEG				KNA00592
		LC-ESI-FT-MS; NEG				KNA00796
		LC-ESI-FT-MS; POS				KNA00193
		LC-ESI-FT-MS; POS				KNA00427
		LC-ESI-IT-MS/MS; m/z:134.05; NEG				KNA00797
		LC-ESI-IT-MS/MS; m/z:134.05; NEG				KNA00593
		LC-ESI-IT-MS/MS; m/z:284.10; POS				KNA00194
		LC-ESI-IT-MS/MS; m/z:328.04; NEG				KNA00798
		LC-ESI-IT-MS/MS; m/z:328.04; NEG				KNA00594
		LC-ESI-IT-MS/MS; m/z:330.06; POS				KNA00428
		LC-ESI-IT-MS/MS; m/z:330.06; POS				KNA00195
		LC-ESI-IT-MS/MS; m/z:331.06; POS				KNA00196
		LC-ESI-IT-MS/MS; m/z:331.06; POS				KNA00429
		LC-ESI-IT-MS/MS; m/z:657.10; NEG				KNA00799
		LC-ESI-IT-MS/MS; m/z:657.10; NEG				KNA00595
		LC-ESI-IT-MS/MS; m/z:659.11; POS				KNA00430

		LC-ESI-FT-MS; NEG				KNA00576
		LC-ESI-FT-MS; NEG				KNA00684
		LC-ESI-FT-MS; POS				KNA00284
		LC-ESI-FT-MS; POS				KNA00173
		LC-ESI-IT-MS/MS; m/z:152.06; POS				KNA00174
		LC-ESI-IT-MS/MS; m/z:196.06; NEG				KNA00577
		LC-ESI-IT-MS/MS; m/z:196.06; NEG				KNA00685
		LC-ESI-IT-MS/MS; m/z:198.08; POS				KNA00175
		LC-ESI-IT-MS/MS; m/z:198.08; POS				KNA00285
		LC-ESI-IT-MS/MS; m/z:244.09; POS				KNA00286
		LC-ESI-IT-MS/MS; m/z:284.10; POS				KNA00176
		LC-ESI-IT-MS/MS; m/z:346.06; NEG				KNA00578
		LC-ESI-IT-MS/MS; m/z:393.13; NEG				KNA00579
		LC-ESI-IT-MS/MS; m/z:487.18; POS				KNA00287
		LC-ESI-IT-MS/MS; m/z:540.05; NEG				KNA00686
		LC-ESI-IT-MS/MS; m/z:662.10; NEG				KNA00687

		LC-ESI-FT-MS; NEG				KNA00820
		LC-ESI-FT-MS; POS				KNA00467
		LC-ESI-IT-MS/MS; m/z:1105.97; NEG				KNA00821
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00468
		LC-ESI-IT-MS/MS; m/z:184.99; NEG				KNA00822
		LC-ESI-IT-MS/MS; m/z:187.00; POS				KNA00469
		LC-ESI-IT-MS/MS; m/z:370.98; NEG				KNA00823
		LC-ESI-IT-MS/MS; m/z:391.28; POS				KNA00470

		LC-ESI-FT-MS; NEG				KNA00534
		LC-ESI-FT-MS; NEG				KNA00720
		LC-ESI-FT-MS; POS				KNA00332
		LC-ESI-FT-MS; POS				KNA00129
		LC-ESI-IT-MS/MS; m/z:152.00; NEG				KNA00721
		LC-ESI-IT-MS/MS; m/z:152.00; NEG				KNA00535
		LC-ESI-IT-MS/MS; m/z:154.02; POS				KNA00333
		LC-ESI-IT-MS/MS; m/z:154.02; POS				KNA00130
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00334
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00131
		LC-ESI-IT-MS/MS; m/z:259.02; NEG				KNA00722
		LC-ESI-IT-MS/MS; m/z:261.04; POS				KNA00335
		LC-ESI-IT-MS/MS; m/z:391.28; POS				KNA00132
		LC-ESI-IT-MS/MS; m/z:418.90; NEG				KNA00536
		LC-ESI-IT-MS/MS; m/z:519.05; NEG				KNA00723
		LC-ESI-IT-MS/MS; m/z:571.90; NEG				KNA00537

		LC-ESI-FT-MS; POS				KNA00316
		LC-ESI-FT-MS; POS				KNA00005
		LC-ESI-IT-MS/MS; m/z:104.07; POS				KNA00317
		LC-ESI-IT-MS/MS; m/z:104.07; POS				KNA00006
		LC-ESI-IT-MS/MS; m/z:105.07; POS				KNA00007
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00318
		LC-ESI-IT-MS/MS; m/z:229.08; POS				KNA00008
		LC-ESI-IT-MS/MS; m/z:494.35; POS				KNA00319

		LC-ESI-FT-MS; NEG				KNA00696
		LC-ESI-FT-MS; POS				KNA00296
		LC-ESI-FT-MS; POS				KNA00037
		LC-ESI-IT-MS/MS; m/z:120.07; POS				KNA00038
		LC-ESI-IT-MS/MS; m/z:126.02; POS				KNA00039
		LC-ESI-IT-MS/MS; m/z:130.05; NEG				KNA00697
		LC-ESI-IT-MS/MS; m/z:132.07; POS				KNA00040
		LC-ESI-IT-MS/MS; m/z:132.07; POS				KNA00297
		LC-ESI-IT-MS/MS; m/z:133.07; POS				KNA00298
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00299
		LC-ESI-IT-MS/MS; m/z:261.11; NEG				KNA00698
		LC-ESI-IT-MS/MS; m/z:446.09; NEG				KNA00699

		LC-ESI-FT-MS; NEG				KNA00816
		LC-ESI-FT-MS; NEG				KNA00596
		LC-ESI-FT-MS; POS				KNA00197
		LC-ESI-FT-MS; POS				KNA00447
		LC-ESI-IT-MS/MS; m/z:1040.18; NEG				KNA00817
		LC-ESI-IT-MS/MS; m/z:136.06; POS				KNA00448
		LC-ESI-IT-MS/MS; m/z:307.08; POS				KNA00198
		LC-ESI-IT-MS/MS; m/z:346.05; NEG				KNA00818
		LC-ESI-IT-MS/MS; m/z:346.06; NEG				KNA00597
		LC-ESI-IT-MS/MS; m/z:348.07; POS				KNA00449
		LC-ESI-IT-MS/MS; m/z:348.07; POS				KNA00199
		LC-ESI-IT-MS/MS; m/z:349.07; POS				KNA00450
		LC-ESI-IT-MS/MS; m/z:611.15; NEG				KNA00598
		LC-ESI-IT-MS/MS; m/z:613.16; POS				KNA00200
		LC-ESI-IT-MS/MS; m/z:693.12; NEG				KNA00599
		LC-ESI-IT-MS/MS; m/z:693.12; NEG				KNA00819

		LC-ESI-FT-MS; NEG				KNA00604
		LC-ESI-FT-MS; POS				KNA00205
		LC-ESI-IT-MS/MS; m/z:134.05; NEG				KNA00605
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00206
		LC-ESI-IT-MS/MS; m/z:405.57; POS				KNA00207
		LC-ESI-IT-MS/MS; m/z:808.12; NEG				KNA00606
		LC-ESI-IT-MS/MS; m/z:809.12; NEG				KNA00607
		LC-ESI-IT-MS/MS; m/z:810.13; POS				KNA00208

		LC-ESI-FT-MS; NEG				KNA00566
		LC-ESI-FT-MS; POS				KNA00157
		LC-ESI-FT-MS; POS				KNA00443
		LC-ESI-IT-MS/MS; m/z:134.05; NEG				KNA00567
		LC-ESI-IT-MS/MS; m/z:135.03; NEG				KNA00568
		LC-ESI-IT-MS/MS; m/z:136.06; POS				KNA00158
		LC-ESI-IT-MS/MS; m/z:136.06; POS				KNA00444
		LC-ESI-IT-MS/MS; m/z:137.05; POS				KNA00159
		LC-ESI-IT-MS/MS; m/z:137.06; POS				KNA00160
		LC-ESI-IT-MS/MS; m/z:137.06; POS				KNA00445
		LC-ESI-IT-MS/MS; m/z:348.07; POS				KNA00446

		LC-ESI-FT-MS; POS				KNA00117
		LC-ESI-FT-MS; POS				KNA00304
		LC-ESI-IT-MS/MS; m/z:193.07; POS				KNA00305
		LC-ESI-IT-MS/MS; m/z:268.10; POS				KNA00118
		LC-ESI-IT-MS/MS; m/z:268.10; POS				KNA00306
		LC-ESI-IT-MS/MS; m/z:269.11; POS				KNA00119
		LC-ESI-IT-MS/MS; m/z:308.09; POS				KNA00120
		LC-ESI-IT-MS/MS; m/z:385.13; POS				KNA00307

		LC-ESI-FT-MS; POS				KNA00435
		LC-ESI-FT-MS; POS				KNA00057
		LC-ESI-IT-MS/MS; m/z:120.04; POS				KNA00436
		LC-ESI-IT-MS/MS; m/z:120.04; POS				KNA00058
		LC-ESI-IT-MS/MS; m/z:138.05; POS				KNA00059
		LC-ESI-IT-MS/MS; m/z:138.06; POS				KNA00437
		LC-ESI-IT-MS/MS; m/z:139.06; POS				KNA00438
		LC-ESI-IT-MS/MS; m/z:139.06; POS				KNA00060

		LC-ESI-FT-MS; NEG				KNA00800
		LC-ESI-FT-MS; POS				KNA00213
		LC-ESI-IT-MS/MS; m/z:158.93; NEG				KNA00801
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00214
		LC-ESI-IT-MS/MS; m/z:384.00; NEG				KNA00802
		LC-ESI-IT-MS/MS; m/z:391.28; POS				KNA00215
		LC-ESI-IT-MS/MS; m/z:402.01; NEG				KNA00803
		LC-ESI-IT-MS/MS; m/z:404.02; POS				KNA00216

		LC-ESI-FT-MS; NEG				KNA00652
		LC-ESI-FT-MS; NEG				KNA00511
		LC-ESI-FT-MS; POS				KNA00109
		LC-ESI-FT-MS; POS				KNA00260
		LC-ESI-IT-MS/MS; m/z:110.07; NEG				KNA00512
		LC-ESI-IT-MS/MS; m/z:114.06; POS				KNA00110
		LC-ESI-IT-MS/MS; m/z:114.06; POS				KNA00261
		LC-ESI-IT-MS/MS; m/z:147.11; POS				KNA00262
		LC-ESI-IT-MS/MS; m/z:156.08; POS				KNA00111
		LC-ESI-IT-MS/MS; m/z:225.10; NEG				KNA00513
		LC-ESI-IT-MS/MS; m/z:225.10; NEG				KNA00653
		LC-ESI-IT-MS/MS; m/z:227.11; POS				KNA00112
		LC-ESI-IT-MS/MS; m/z:227.11; POS				KNA00263
		LC-ESI-IT-MS/MS; m/z:293.09; NEG				KNA00654
		LC-ESI-IT-MS/MS; m/z:451.21; NEG				KNA00514
		LC-ESI-IT-MS/MS; m/z:473.19; NEG				KNA00655

		LC-ESI-FT-MS; NEG				KNA00812
		LC-ESI-FT-MS; NEG				KNA00550
		LC-ESI-IT-MS/MS; m/z:111.01; NEG				KNA00813
		LC-ESI-IT-MS/MS; m/z:111.01; NEG				KNA00551
		LC-ESI-IT-MS/MS; m/z:191.02; NEG				KNA00814
		LC-ESI-IT-MS/MS; m/z:191.02; NEG				KNA00552
		LC-ESI-IT-MS/MS; m/z:346.06; NEG				KNA00815
		LC-ESI-IT-MS/MS; m/z:435.96; NEG				KNA00553

		LC-ESI-FT-MS; NEG				KNA00772
		LC-ESI-FT-MS; NEG				KNA00558
		LC-ESI-FT-MS; POS				KNA00149
		LC-ESI-FT-MS; POS				KNA00392
		LC-ESI-IT-MS/MS; m/z:122.03; POS				KNA00150
		LC-ESI-IT-MS/MS; m/z:130.06; NEG				KNA00559
		LC-ESI-IT-MS/MS; m/z:130.06; NEG				KNA00773
		LC-ESI-IT-MS/MS; m/z:132.08; POS				KNA00151
		LC-ESI-IT-MS/MS; m/z:132.08; POS				KNA00393
		LC-ESI-IT-MS/MS; m/z:133.08; POS				KNA00394
		LC-ESI-IT-MS/MS; m/z:261.13; NEG				KNA00560
		LC-ESI-IT-MS/MS; m/z:261.13; NEG				KNA00774
		LC-ESI-IT-MS/MS; m/z:263.15; POS				KNA00152
		LC-ESI-IT-MS/MS; m/z:263.15; POS				KNA00395
		LC-ESI-IT-MS/MS; m/z:392.20; NEG				KNA00775
		LC-ESI-IT-MS/MS; m/z:392.20; NEG				KNA00561

		LC-ESI-FT-MS; NEG				KNA00620
		LC-ESI-FT-MS; NEG				KNA00692
		LC-ESI-FT-MS; POS				KNA00292
		LC-ESI-FT-MS; POS				KNA00225
		LC-ESI-IT-MS/MS; m/z:112.05; POS				KNA00226
		LC-ESI-IT-MS/MS; m/z:198.08; POS				KNA00293
		LC-ESI-IT-MS/MS; m/z:242.08; NEG				KNA00621
		LC-ESI-IT-MS/MS; m/z:242.08; NEG				KNA00693
		LC-ESI-IT-MS/MS; m/z:244.09; POS				KNA00294
		LC-ESI-IT-MS/MS; m/z:244.09; POS				KNA00227
		LC-ESI-IT-MS/MS; m/z:288.08; NEG				KNA00622
		LC-ESI-IT-MS/MS; m/z:288.08; NEG				KNA00694
		LC-ESI-IT-MS/MS; m/z:487.18; POS				KNA00295
		LC-ESI-IT-MS/MS; m/z:531.17; NEG				KNA00623
		LC-ESI-IT-MS/MS; m/z:540.05; NEG				KNA00695

		LC-ESI-FT-MS; POS				KNA00017
		LC-ESI-FT-MS; POS				KNA00431
		LC-ESI-IT-MS/MS; m/z:112.05; POS				KNA00018
		LC-ESI-IT-MS/MS; m/z:112.05; POS				KNA00432
		LC-ESI-IT-MS/MS; m/z:158.00; POS				KNA00433
		LC-ESI-IT-MS/MS; m/z:223.09; POS				KNA00434
		LC-ESI-IT-MS/MS; m/z:223.09; POS				KNA00019
		LC-ESI-IT-MS/MS; m/z:224.10; POS				KNA00020

		LC-ESI-FT-MS; POS				KNA00348
		LC-ESI-FT-MS; POS				KNA00001
		LC-ESI-IT-MS/MS; m/z:104.07; POS				KNA00349
		LC-ESI-IT-MS/MS; m/z:104.07; POS				KNA00002
		LC-ESI-IT-MS/MS; m/z:106.05; POS				KNA00003
		LC-ESI-IT-MS/MS; m/z:122.03; POS				KNA00350
		LC-ESI-IT-MS/MS; m/z:171.15; POS				KNA00351
		LC-ESI-IT-MS/MS; m/z:207.13; POS				KNA00004

		LC-ESI-FT-MS; NEG				KNA00636
		LC-ESI-FT-MS; NEG				KNA00546
		LC-ESI-IT-MS/MS; m/z:150.04; NEG				KNA00637
		LC-ESI-IT-MS/MS; m/z:151.03; NEG				KNA00547
		LC-ESI-IT-MS/MS; m/z:195.05; NEG				KNA00638
		LC-ESI-IT-MS/MS; m/z:195.05; NEG				KNA00548
		LC-ESI-IT-MS/MS; m/z:301.09; NEG				KNA00639
		LC-ESI-IT-MS/MS; m/z:513.95; NEG				KNA00549