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. 2017 May 17;28(9):1775–1786. doi: 10.1007/s13361-017-1676-1

Table 2.

Ions Observed Following SCW Hydrolysis of VCFQYMDRGDR at 140 °C for 10 min

m/z z Calculated mass (Da) Measured mass (Da) Peptide ΔPPM
463.8730 3 1388.5965 1388.5972 VCFQYMDRGDR 0.5
468.5323 3 1402.5758 1402.5751 VCFQYMDRGDR (–H2O+2O) -0.5
473.8640 3 1418.5707 1418.5702 VCFQYMDRGDR (–H2O+3O) –0.4
474.5359 3 1420.5863 1420.5859 VCFQYMDRGDR (+2O) –0.3
479.8675 3 1436.5812 1436.5807 VCFQYMDRGDR (+3O) –0.4
624.2444 2 1246.4747 1246.4742 VCFQYMDRGD (–H2O+2O) –0.3
632.2418 2 1262.4696 1262.4690 VCFQYMDRGD (–H2O+3O) –0.4
633.2498 2 1264.4852 1264.4850 VCFQYMDRGD (+2O) –0.1
635.2353 2 1268.4561 1268.4560 VCFQYMDRGD (–H2O+2O+Na) 0.0
641.2472 2 1280.4811 1280.4798 VCFQYMDRGD (+3O) –1.0
643.2327 2 1284.4510 1284.4508 VCFQYMDRGD (–H2O+3O+Na) –0.1
652.2381 2 1302.4625 1302.4616 VCFQYMDRGD (+3O+Na) –0.7
702.2950 2 1402.5758 1402.5754 VCFQYMDRGDR (–H2O+2O) –0.2
710.2924 2 1418.5707 1418.5702 VCFQYMDRGDR (–H2O+3O) –0.3
711.3004 2 1420.5863 1420.5862 VCFQYMDRGDR (+2O) –0.1
718.2898 2 1434.5656 1434.5650 VCFQYMDRGDR (–H2O+4O) –0.4
719.2999 2 1436.5812 1436.5852 VCFQYMDRGDR (+3O) 2.8
727.2950 2 1452.5761 1452.5754 VCFQYMDRGDR (+4O) –0.5
1229.4707 1 1228.4641 1228.4634 VCFQYMDRGD (–2H2O+2O) –0.6
1247.4811 1 1246.4747 1246.4738 VCFQYMDRGD (–H2O+2O) –0.7
1263.4760 1 1262.4696 1262.4687 VCFQYMDRGD (–H2O+3O) –0.7
1265.4926 1 1264.4852 1264.4853 VCFQYMDRGD (+2O) 0.1
1281.4868 1 1280.4811 1280.4795 VCFQYMDRGD (+3O) –1.2
1285.4578 1 1284.4510 1284.4505 VCFQYMDRGD (–H2O+3O+Na) –0.3