Table 3.
The detailed information for the matching b and y fragment ions as marked in Fig. 5C
| Name | m/z | Mass monoisotopic (Da) | Theoretical mass (Da) | Error (ppm) | Name | m/z | Mass monoisotopic (Da) | Theoretical mass (Da) | Error (ppm) |
|---|---|---|---|---|---|---|---|---|---|
| B3 | 343.17 | 342.17 | 342.17 | 2.98 | Y23 | 1252.17 | 2502.33 | 2502.31 | 9.01 |
| B8 | 770.42 | 769.42 | 769.42 | −3.60 | Y24 | 1316.21 | 2630.40 | 2630.40 | 0.89 |
| B17 | 818.98 | 1635.94 | 1635.93 | 4.43 | Y28 | 781.68 | 3122.70 | 3122.69 | 1.97 |
| B25 | 671.64 | 2682.53 | 2682.54 | −2.82 | Y30 | 1118.60 | 3352.77 | 3352.78 | −4.33 |
| B35 | 753.04 | 3760.17 | 3760.20 | −8.90 | Y31 | 1172.95 | 3515.83 | 3515.85 | −6.04 |
| B39 | 852.31 | 4256.52 | 4256.53 | −2.22 | Y32 | 1206.64 | 3616.91 | 3616.90 | 4.43 |
| B40 | 736.44 | 4412.61 | 4412.63 | −4.32 | Y33 | 1239.67 | 3716.00 | 3715.96 | 8.59 |
| B52 | 813.20 | 5685.36 | 5685.35 | 2.23 | Y34 | 1263.34 | 3787.00 | 3787.00 | −0.35 |
| B53 | 970.07 | 5814.38 | 5814.39 | −1.53 | Y39 | 1097.09 | 4384.33 | 4384.32 | 0.24 |
| B62 | 854.51 | 6828.02 | 6828.03 | −1.93 | Y42 | 1194.39 | 4773.51 | 4773.52 | −1.06 |
| B68 | 840.38 | 7554.35 | 7554.40 | −6.62 | Y43 | 1219.16 | 4872.60 | 4872.59 | 2.86 |
| B70 | 966.56 | 7724.45 | 7724.50 | −6.71 | Y47 | 1318.48 | 5269.88 | 5269.86 | 5.25 |
| Y11 | 606.32 | 1201.63 | 1210.62 | 5.78 | Y49 | 922.17 | 5527.00 | 5527.01 | −1.88 |
| Y13 | 726.91 | 1451.81 | 1451.80 | 6.19 | Y49 | 1106.41 | 5527.00 | 5527.01 | −1.55 |
| Y14 | 762.43 | 1522.85 | 1522.84 | 6.17 | Y50 | 1132.21 | 5655.99 | 5656.05 | −9.62 |
| Y15 | 843.96 | 1685.91 | 1685.90 | 3.48 | Y57 | 1287.30 | 6341.45 | 6431.46 | −1.82 |
| Y16 | 893.50 | 1784.98 | 1784.97 | 5.93 | Y63 | 1013.13 | 7084.84 | 7084.87 | −4.29 |
| Y18 | 1000.54 | 1999.06 | 1999.07 | −1.06 | Y67 | 1084.04 | 7581.22 | 7581.19 | 4.11 |
| Y19 | 1066.05 | 2130.09 | 2130.11 | −5.44 | Y77 | 1083.37 | 8658.92 | 8658.86 | 6.60 |
| Y20 | 1101.57 | 2201.13 | 2201.14 | −6.18 | Y90 | 1022.68 | 10216.78 | 10216.80 | 2.12 |
| Y21 | 1152.09 | 2302.17 | 2302.19 | −7.76 | Y94 | 962.10 | 10572.00 | 10572.00 | 1.85 |
| Y22 | 1201.63 | 2401.25 | 2401.26 | −3.50 |