Shotgun Ion-Mobility Mass Spectrometry Sequencing (SIMMS2) for glycosaminoglycan oligosaccharides
Precursor
GlyTouCan Accession Number:
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| Peak | Intensity |
|---|---|
| 96.9732 | 6710.0 |
| 98.97 | 282.0 |
| 113.0408 | 2080.0 |
| 138.0073 | 758.0 |
| 138.9907 | 460.0 |
| 150.0145 | 29.3 |
| 159.5073 | 7770.0 |
| 168.514 | 3500.0 |
| 175.0493 | 1590.0 |
| 176.052 | 131.0 |
| 182.076 | 2500.0 |
| 187.0354 | 1220.0 |
| 199.0201 | 1020.0 |
| 204.0265 | 1310.0 |
| 206.5445 | 272.0 |
| 207.0467 | 98.8 |
| 207.5522 | 11100.0 |
| 209.0506 | 265.0 |
| 211.0668 | 225000.0 |
| 211.5668 | 24500.0 |
| 212.5661 | 2490.0 |
| 216.5579 | 1350.0 |
| 216.7832 | 18.0 |
| 217.0551 | 249.0 |
| 218.057 | 265.0 |
| 222.041 | 1330.0 |
| 225.5402 | 329.0 |
| 232.0739 | 230.0 |
| 235.072 | 155.0 |
| 238.0414 | 152.0 |
| 239.0538 | 70.9 |
| 240.0534 | 8310.0 |
| 240.4236 | 45.0 |
| 241.0588 | 519.0 |
| 244.3707 | 151.0 |
| 245.0438 | 10500.0 |
| 246.4766 | 22.7 |
| 246.53 | 1050.0 |
| 247.0333 | 274.0 |
| 247.4535 | 12.8 |
| 247.537 | 18900.0 |
| 248.0378 | 3340.0 |
| 248.5362 | 2800.0 |
| 252.756 | 673.0 |
| 255.5346 | 218.0 |
| 255.5986 | 883.0 |
| 256.0962 | 549.0 |
| 256.5438 | 6090.0 |
| 257.5426 | 1190.0 |
| 257.6017 | 46.3 |
| 258.0734 | 876.0 |
| 258.5885 | 104.0 |
| 259.1115 | 35700.0 |
| 259.612 | 7380.0 |
| 271.0636 | 150.0 |
| 271.7035 | 283.0 |
| 273.5831 | 369.0 |
| 276.0927 | 246.0 |
| 276.4013 | 554.0 |
| 277.0738 | 10500.0 |
| 277.4087 | 2960.0 |
| 277.7399 | 1480.0 |
| 278.0748 | 619.0 |
| 278.744 | 3430.0 |
| 279.0774 | 2350.0 |
| 279.4178 | 150000.0 |
| 279.6677 | 124.0 |
| 279.7509 | 41300.0 |
| 280.0984 | 6470.0 |
| 280.5488 | 68.8 |
| 280.7498 | 2260.0 |
| 284.7915 | 849.0 |
| 287.5486 | 25.7 |
| 289.0753 | 156.0 |
| 289.7537 | 136.0 |
| 290.0871 | 1040.0 |
| 290.4286 | 191.0 |
| 292.0804 | 32.7 |
| 293.053 | 102.0 |
| 293.419 | 219.0 |
| 293.7247 | 300.0 |
| 295.1107 | 985.0 |
| 295.5834 | 19900.0 |
| 296.0856 | 4120.0 |
| 297.7262 | 2890.0 |
| 298.5832 | 82.9 |
| 298.7296 | 221.0 |
| 299.0959 | 16100.0 |
| 299.426 | 27.3 |
| 299.5973 | 3760.0 |
| 300.0947 | 2210.0 |
| 300.596 | 439.0 |
| 301.0936 | 166.0 |
| 303.7352 | 262000.0 |
| 304.0662 | 81200.0 |
| 304.3989 | 52800.0 |
| 304.7322 | 11800.0 |
| 305.0654 | 3940.0 |
| 306.0751 | 3810.0 |
| 306.4098 | 1490.0 |
| 307.1015 | 215.0 |
| 310.7746 | 10100.0 |
| 311.1081 | 5120.0 |
| 311.4498 | 222000.0 |
| 311.8759 | 82.5 |
| 316.7581 | 1410.0 |
| 319.0972 | 25.5 |
| 322.0926 | 193.0 |
| 322.4451 | 74.0 |
| 322.9278 | 984.0 |
| 324.3835 | 1400.0 |
| 324.7175 | 656.0 |
| 325.114 | 42.8 |
| 328.0858 | 2260.0 |
| 328.3728 | 38.7 |
| 329.718 | 835.0 |
| 330.3879 | 19900.0 |
| 330.7217 | 7940.0 |
| 331.0553 | 6250.0 |
| 332.0961 | 3230.0 |
| 332.43 | 1280.0 |
| 332.7619 | 1600.0 |
| 333.0916 | 638.0 |
| 333.4716 | 66.3 |
| 334.5598 | 2500.0 |
| 334.9125 | 240.0 |
| 335.0641 | 981.0 |
| 335.4741 | 211.0 |
| 335.5697 | 91200.0 |
| 336.2357 | 103.0 |
| 336.7599 | 1780.0 |
| 337.0801 | 2210.0 |
| 337.1455 | 532.0 |
| 337.4342 | 200000.0 |
| 337.5764 | 949.0 |
| 337.7679 | 115000.0 |
| 337.9255 | 1090.0 |
| 338.0286 | 2620.0 |
| 338.1194 | 6720000.0 |
| 338.258 | 228000.0 |
| 338.4531 | 2600000.0 |
| 338.5999 | 37300.0 |
| 338.7849 | 1680000.0 |
| 339.1104 | 345000.0 |
| 339.4383 | 88300.0 |
| 339.7689 | 18800.0 |
| 339.9725 | 225.0 |
| 340.1155 | 3340.0 |
| 341.1145 | 153.0 |
| 341.4473 | 126.0 |
| 342.1049 | 356.0 |
| 342.8901 | 104.0 |
| 343.1711 | 65900.0 |
| 343.5026 | 57.0 |
| 344.173 | 4840.0 |
| 344.5746 | 10500.0 |
| 345.1244 | 87.0 |
| 345.5742 | 1980.0 |
| 349.4268 | 299.0 |
| 350.7579 | 133.0 |
| 351.9439 | 1370.0 |
| 352.4407 | 361.0 |
| 353.728 | 73.9 |
| 354.1575 | 1930.0 |
| 355.1501 | 293.0 |
| 355.6228 | 291.0 |
| 358.7546 | 726.0 |
| 359.0851 | 288.0 |
| 360.644 | 27.7 |
| 364.0885 | 24800.0 |
| 364.1705 | 3990.0 |
| 364.3431 | 426.0 |
| 364.4229 | 17000.0 |
| 364.5475 | 327.0 |
| 364.6328 | 2200.0 |
| 364.7773 | 1370000.0 |
| 365.1111 | 622000.0 |
| 365.2258 | 8380.0 |
| 365.4344 | 397000.0 |
| 365.6078 | 1280.0 |
| 365.763 | 100000.0 |
| 365.9235 | 1070.0 |
| 366.0946 | 39500.0 |
| 366.2061 | 7160.0 |
| 366.3449 | 568.0 |
| 366.5791 | 1030.0 |
| 366.7649 | 3360.0 |
| 366.8987 | 1450.0 |
| 367.1648 | 4330.0 |
| 367.226 | 4990.0 |
| 368.1208 | 1740.0 |
| 369.1159 | 115.0 |
| 369.4398 | 115.0 |
| 369.6306 | 272.0 |
| 370.6352 | 691.0 |
| 376.128 | 855.0 |
| 376.5136 | 22.1 |
| 376.6227 | 245.0 |
| 378.6369 | 649.0 |
| 379.5722 | 66.0 |
| 379.6441 | 28500.0 |
| 379.7537 | 66.5 |
| 380.1445 | 7350.0 |
| 380.6427 | 4820.0 |
| 384.5589 | 303.0 |
| 395.6007 | 566.0 |
| 400.6522 | 1020.0 |
| 407.1088 | 2540.0 |
| 407.1855 | 15.5 |
| 407.6124 | 683.0 |
| 408.11 | 637.0 |
| 409.1189 | 46.4 |
| 410.62 | 1460.0 |
| 416.1152 | 25100.0 |
| 416.6177 | 4730.0 |
| 417.1164 | 3760.0 |
| 417.6164 | 818.0 |
| 418.1131 | 652.0 |
| 418.6821 | 1490.0 |
| 419.2594 | 23.0 |
| 419.6291 | 5850.0 |
| 420.6297 | 1350.0 |
| 423.1406 | 1880.0 |
| 424.1413 | 270.0 |
| 429.6577 | 134.0 |
| 430.6628 | 126.0 |
| 434.127 | 1110.0 |
| 446.0883 | 235.0 |
| 447.094 | 10300.0 |
| 447.3307 | 44.0 |
| 447.5966 | 3490.0 |
| 448.184 | 28.8 |
| 448.5969 | 709.0 |
| 449.0986 | 202.0 |
| 455.2034 | 216.0 |
| 456.0997 | 857.0 |
| 457.1872 | 65.9 |
| 457.6581 | 956.0 |
| 458.1602 | 619.0 |
| 458.2234 | 132.0 |
| 458.6666 | 11900.0 |
| 459.1686 | 4450.0 |
| 460.1646 | 730.0 |
| 466.665 | 979.0 |
| 467.1664 | 308.0 |
| 467.5917 | 14.0 |
| 467.6694 | 262.0 |
| 497.6449 | 1520.0 |
| 498.1441 | 958.0 |
| 498.6526 | 48700.0 |
| 499.1545 | 20100.0 |
| 499.2391 | 43.4 |
| 499.6527 | 9820.0 |
| 512.2051 | 9630.0 |
| 519.2303 | 2790.0 |
| 519.3363 | 37.4 |
| 520.2325 | 410.0 |
| 592.175 | 9280.0 |
| 592.2714 | 45.0 |
| 593.1758 | 1100.0 |
| 593.6018 | 32.8 |
| 594.1721 | 601.0 |
| 606.8554 | 82.9 |
| 610.1885 | 199.0 |
There are 3 similar spectra:
| Id | Structure | Score |
|---|---|---|
|
|
|
1.00 |
|
5325 |
|
0.98 |
|
|
|
0.98 |
Reducing Mass: 1010.04
(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
