Shotgun Ion-Mobility Mass Spectrometry Sequencing (SIMMS2) for glycosaminoglycan oligosaccharides
GlyTouCan Accession Number:
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| Peak | Intensity |
|---|---|
| 108.0295 | 137000.0 |
| 108.0628 | 156.0 |
| 109.0296 | 4420.0 |
| 123.0505 | 22700.0 |
| 124.0532 | 1140.0 |
| 198.9993 | 253.0 |
| 228.5377 | 591.0 |
| 237.5425 | 762.0 |
| 258.5485 | 1430.0 |
| 268.5162 | 305.0 |
| 282.0408 | 6260.0 |
| 295.0804 | 394.0 |
| 296.3812 | 48.7 |
| 299.0803 | 76.9 |
| 300.0516 | 2180.0 |
| 305.0515 | 399.0 |
| 314.4476 | 624.0 |
| 316.0606 | 50.2 |
| 316.5593 | 19200.0 |
| 317.0593 | 3230.0 |
| 317.1339 | 26.0 |
| 317.5587 | 1410.0 |
| 325.0616 | 2130.0 |
| 325.3949 | 579.0 |
| 325.7282 | 327.0 |
| 326.3963 | 77.7 |
| 330.0823 | 1730.0 |
| 334.6611 | 5510.0 |
| 335.4636 | 547.0 |
| 339.0826 | 333.0 |
| 345.068 | 523.0 |
| 346.4052 | 566.0 |
| 346.4683 | 70.0 |
| 346.5768 | 398.0 |
| 346.7433 | 430.0 |
| 347.8142 | 256.0 |
| 350.2728 | 238.0 |
| 360.1087 | 377.0 |
| 363.07 | 123.0 |
| 363.668 | 99.1 |
| 363.7334 | 3660.0 |
| 364.07 | 1450.0 |
| 364.3028 | 45.9 |
| 366.269 | 14900.0 |
| 366.6994 | 153.0 |
| 369.0549 | 481.0 |
| 369.4632 | 76.0 |
| 370.0642 | 9750.0 |
| 370.2825 | 29.4 |
| 370.474 | 24.8 |
| 370.5642 | 1950.0 |
| 371.0634 | 1160.0 |
| 371.7234 | 1310.0 |
| 372.7487 | 1050.0 |
| 373.2605 | 44.6 |
| 373.3262 | 1390.0 |
| 373.8285 | 355.0 |
| 374.5765 | 995.0 |
| 375.0848 | 2270.0 |
| 375.2889 | 1450.0 |
| 378.1136 | 921.0 |
| 379.0692 | 5600.0 |
| 384.4051 | 73.0 |
| 384.7519 | 106.0 |
| 385.4278 | 87.1 |
| 387.3204 | 431.0 |
| 389.0762 | 146.0 |
| 389.7793 | 37.7 |
| 390.0758 | 478.0 |
| 390.4366 | 147.0 |
| 390.6861 | 8750.0 |
| 391.2066 | 4820.0 |
| 391.5257 | 1860.0 |
| 392.0959 | 46100.0 |
| 392.539 | 239.0 |
| 393.3156 | 11300.0 |
| 393.6436 | 58.5 |
| 394.1413 | 43.1 |
| 395.0825 | 179.0 |
| 398.6737 | 853.0 |
| 399.4048 | 5530.0 |
| 399.7387 | 2420.0 |
| 400.7215 | 162.0 |
| 405.0781 | 403.0 |
| 405.4077 | 7860.0 |
| 405.742 | 3800.0 |
| 408.0764 | 515.0 |
| 408.3186 | 222.0 |
| 409.0939 | 1560.0 |
| 409.5954 | 687.0 |
| 410.0902 | 232.0 |
| 411.3482 | 177.0 |
| 413.4937 | 99.4 |
| 414.1563 | 43.4 |
| 414.5771 | 2370.0 |
| 414.8276 | 902.0 |
| 416.0191 | 145.0 |
| 416.0896 | 282.0 |
| 416.7542 | 66.7 |
| 418.6792 | 324.0 |
| 419.0812 | 25400.0 |
| 419.3306 | 7770.0 |
| 424.0742 | 627.0 |
| 424.3298 | 198.0 |
| 425.3392 | 53.8 |
| 425.574 | 163.0 |
| 427.0223 | 11.1 |
| 427.1071 | 2060.0 |
| 429.0801 | 1290.0 |
| 429.3348 | 1080.0 |
| 431.4307 | 1700.0 |
| 432.0973 | 372.0 |
| 437.4327 | 716.0 |
| 438.1014 | 74900.0 |
| 438.3497 | 36500.0 |
| 438.5981 | 22600.0 |
| 438.7182 | 63.2 |
| 438.8489 | 8520.0 |
| 439.1172 | 1210.0 |
| 439.5978 | 459.0 |
| 443.077 | 450.0 |
| 444.835 | 653.0 |
| 447.0859 | 1690.0 |
| 447.5856 | 2020.0 |
| 449.0816 | 274.0 |
| 449.9915 | 63.6 |
| 450.581 | 789.0 |
| 451.0876 | 1180.0 |
| 457.2859 | 201.0 |
| 457.584 | 27300.0 |
| 457.8454 | 90500.0 |
| 458.109 | 1560000.0 |
| 458.3601 | 1360000.0 |
| 458.4347 | 30000.0 |
| 458.5201 | 97300.0 |
| 458.6097 | 1250000.0 |
| 458.6886 | 25300.0 |
| 458.7697 | 82600.0 |
| 458.8573 | 609000.0 |
| 458.9369 | 8740.0 |
| 459.1075 | 239000.0 |
| 459.1826 | 2690.0 |
| 459.3452 | 83900.0 |
| 459.5894 | 19900.0 |
| 459.8682 | 180.0 |
| 462.2033 | 102.0 |
| 463.5827 | 1670.0 |
| 463.8285 | 871.0 |
| 464.1442 | 86.1 |
| 465.4093 | 213.0 |
| 467.0871 | 911.0 |
| 469.4385 | 385.0 |
| 470.1105 | 188.0 |
| 471.4335 | 337.0 |
| 471.765 | 79.6 |
| 472.1009 | 127.0 |
| 475.1223 | 288.0 |
| 476.0941 | 3540.0 |
| 478.1226 | 839.0 |
| 480.7495 | 157.0 |
| 481.7406 | 86.2 |
| 481.8243 | 43.3 |
| 484.1049 | 986.0 |
| 484.7749 | 414.0 |
| 486.0853 | 94.3 |
| 489.3461 | 378.0 |
| 490.1114 | 4580.0 |
| 490.1871 | 35.2 |
| 490.4466 | 3030.0 |
| 496.0955 | 526.0 |
| 497.1131 | 692.0 |
| 498.0999 | 837.0 |
| 499.4532 | 212.0 |
| 505.1304 | 4100.0 |
| 505.7971 | 916.0 |
| 505.9467 | 82.8 |
| 506.1246 | 6160.0 |
| 510.7598 | 227.0 |
| 515.1013 | 613.0 |
| 515.5978 | 205.0 |
| 515.7588 | 22.7 |
| 516.1023 | 267.0 |
| 516.7643 | 5020.0 |
| 517.4304 | 1800.0 |
| 518.1053 | 2160.0 |
| 518.6074 | 578.0 |
| 518.7581 | 13.4 |
| 519.1154 | 341.0 |
| 519.6478 | 7460.0 |
| 520.0729 | 78.0 |
| 520.1486 | 2280.0 |
| 520.6475 | 806.0 |
| 521.1496 | 217.0 |
| 525.782 | 1100.0 |
| 526.015 | 20.5 |
| 526.1135 | 760.0 |
| 526.3027 | 36.1 |
| 526.4442 | 553.0 |
| 529.1464 | 326.0 |
| 530.6242 | 40.0 |
| 530.7654 | 356.0 |
| 531.1028 | 462.0 |
| 531.4481 | 624.0 |
| 531.7871 | 24800.0 |
| 532.1188 | 12600.0 |
| 532.4518 | 6130.0 |
| 532.7857 | 2870.0 |
| 533.1176 | 1020.0 |
| 533.4528 | 357.0 |
| 545.0972 | 164.0 |
| 545.7892 | 459.0 |
| 546.1068 | 2360.0 |
| 546.4526 | 124.0 |
| 546.6046 | 920.0 |
| 554.1622 | 804.0 |
| 555.1697 | 137.0 |
| 557.084 | 94.4 |
| 559.1168 | 275.0 |
| 559.6301 | 20900.0 |
| 560.1304 | 7160.0 |
| 561.1259 | 848.0 |
| 561.6257 | 197.0 |
| 568.6326 | 2700.0 |
| 569.133 | 1040.0 |
| 569.6357 | 536.0 |
| 571.0864 | 301.0 |
| 572.012 | 35.4 |
| 572.1181 | 1040.0 |
| 581.2136 | 305.0 |
| 599.218 | 184.0 |
| 607.6661 | 571.0 |
| 608.1719 | 367.0 |
| 608.666 | 191.0 |
| 616.1122 | 414.0 |
| 616.6724 | 598.0 |
| 617.6818 | 156.0 |
| 634.1161 | 200.0 |
| 639.6455 | 50.7 |
| 647.6485 | 725.0 |
| 648.6431 | 198.0 |
| 661.1701 | 1720.0 |
| 662.1727 | 283.0 |
| 662.9327 | 22.6 |
| 663.1662 | 114.0 |
| 679.1803 | 603.0 |
| 757.2484 | 171.0 |
| 775.2256 | 89.0 |
There are 9 similar spectra:
| Id | Structure | Score |
|---|---|---|
|
|
|
1.00 |
|
5357 |
|
0.84 |
|
|
|
0.84 |
|
5345 |
|
0.64 |
|
|
|
0.64 |
|
5354 |
|
0.64 |
|
|
|
0.64 |
|
5348 |
|
0.63 |
|
|
|
0.63 |
Reducing Mass: 1852.28
(Calculated Monoisotopic)
Reducing End: Free reducing end
Persubstitution: Underivatised
N/A
Column
Method
Waters Synapt G2-S HDMS
UniCarb-DR 
Supported by SIB ExPASy | JST / NBDCDICP
