Table 3.
Production | Calculated m/z |
Observed m/z |
Deviation (Da) |
|
---|---|---|---|---|
|
1919.0155 | 1918.8827 | −0.1328 | |
[y3−B2]+ | 1678.8036 | 1678.5926 | −0.2110 | |
|
1671.9099 | 1671.8412 | −0.0687 | |
[y12−B6]+ | 1572.8410 | 1572.8264 | −0.0146 | |
[b12−B6]+ | 1525.8049 | 1525.6882 | −0.1167 | |
[y2-B2]+ | 1515.7400 | 1515.7789 | 0.0389 | |
[y7−B5]+ | 1414.7817 | 1414.6484 | −0.1333 | |
[y5−B4]+ | 1394.7290 | 1395.4213 | 0.6923 | |
[y10−B6]+ | 1352.7562 | 1352.6128 | −0.1434 | |
[y9 − b6]+ | 1238.7132 | 1238.5317 | −0.1815 | |
[ys−B6]+ | 1167.6761 | 1167.6173 | −0.0588 | |
[y5−B5]+ | 1147.6234 | 1147.5979 | −0.0255 | |
[y7 − B6]+ | 1070.6234 | 1070.6128 | −0.0106 | |
[y2 − B4]+ | 1021.5289 | 1021.5341 | 0.0052 | |
[y6 − B6]+ | 1013.6019 | 1013.5967 | −0.0052 | |
[y5 − b6]+ | 900.5178 | 900.4948 | −0.0230 | |
|
836.4589 | 836.4098 | −0.0491 | |
[y4−B6]+ | 803.4651 | 804.0202 | 0.5551 | |
|
772.3994 | 772.4025 | 0.0031 | |
[y3−B6]+ | 690.3810 | 690.3774 | −0.0036 | |
|
659.3153 | 659.3617 | 0.0464 | |
[y2 − B6]+ | 527.3177 | 527.3047 | −0.0130 | |
|
509.2347 | 509.2240 | −0.0107 | |
|
505.2411 | 505.2137 | −0.0274 | |
[B3−B1]+ | 495.2184 | 495.2060 | −0.0124 | |
[B3 − B1 − H2O]+ | 477.2079 | 477.1967 | −0.0112 | |
|
336.1918 | 336.1852 | −0.0066 | |
|
262.1285 | 262.1181 | −0.0104 | |
[B2−B1]+ | 248.1129 | 248.1006 | −0.0123 | |
[B, − H2O]+ | 244.1179 | 244.1063 | −0.0116 | |
[B1−CH3OH]+ | 230.1023 | 230.0915 | −0.0108 | |
|
157.0977 | 156.0629 | −1.0348 | |
[B1−C4H6O3−H2O]+ | 142.0863 | 142.0774 | −0.0089 |