L-Homoserine; LC-ESI-ITFT; MS; NEG

Outputs for L-Homoserine; LC-ESI-ITFT; MS; NEG

Database: Graduate School of Information Science, NAIST
Entry ID: KNA00728
Synonyms: L-Homoserine, 2-Amino-4-hydroxybutyric acid
Total mass: 119.1188
Formula: H9 C4 O3 N1

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS
Instrument: LTQ Orbitrap XL, Thermo Scientfic
Instrument type: LC-ESI-ITFT
Ionization: ESI
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks: 121.610229,123.63944,127.022905,129.513489,133.231519,136.713369,139.006578,143.080591,145.890149,147.92197,150.570154,153.499353,156.024001,158.924781,161.904489,165.998396,168.961335,171.071772,173.960469,176.008842,178.9815,181.045803,183.713482,186.037685,189.980043,192.891898,196.991585,200.390614,202.829211,205.924234,207.946068,210.13588,212.279219,214.913125,217.076371,219.703719,222.098638,225.982852,228.570879,232.033429,237.035003,239.112863,243.92259,246.029891,248.938266,251.998251,255.868816,257.989048,260.087397,263.070297,265.47852,271.631804,274.879796,278.175,281.01735,283.845655,286.025612,289.011727,291.03384,299.021518,305.082023,310.991639,313.009476,319.950701,325.00851,327.077338,330.003647,337.033102,341.116886,344.94709,347.978408,351.801638,354.022428,357.053306,371.055516,376.29451,380.12428,382.860959,386.925364,392.561111,395.019275,397.542529,400.082477,402.105496,406.122062,409.004108,411.08896,414.352203,416.53916,421.60574,426.020086,429.063173,432.067706,442.051724,445.053794,454.002635,458.089199,462.00972,468.043895,471.004003,476.975629,479.697294,492.58356,494.95916,497.052459,499.097969,511.793513,516.054893,520.820791,528.136806,533.890895,543.100271,550.118872,552.653083,558.898464,573.959413,582.056007,589.069797,595.038427,603.639997,613.097155,618.658676,637.94877,645.860539,652.948433,677.957908,683.119872,685.873983,692.164642,702.117265,708.191512,711.69028,715.486148,737.922929,742.064534,745.848416,762.071393,790.015383,808.116724,833.204041,840.038924,843.064619,853.247235,872.837366,882.11868,891.081272,901.407041,905.974967,911.14382,953.150538,955.763347,963.519631,971.73116,980.082893,999.239699,1005.969235,1028.705617,1033.905352,1047.850271,1062.138088,1065.152854,1070.36042,1091.938519,1105.965432,1109.943929,1129.487699,1152.185581,1155.9558,1165.406333,1171.889954,1182.97315,1189.92977,1205.95664,1207.976791,1213.109301,1233.969956,1256.946286,1265.978062,1282.963258,1287.16699,1300.709039,1305.873658,1309.653159,1326.413749,1333.966349,1357.506514,1363.840935,1365.965443,1371.504776,1382.957032,1433.958002,1455.925551,1465.969084,1473.612841,1482.955151,1493.225652,
Replicated queried mass peaks: 100.623754, 100.742284, 101.628195, 102.920423, 103.123118, 103.258778, 103.363132, 103.920096, 104.660372, 106.5262, 108.020738, 109.490433, 110.649797, 111.482839, 112.985421, 112.986782, 112.987463, 112.998809, 113.098502, 114.120462, 114.951622, 115.530801, 115.790954, 115.851712, 116.51015, 117.984285, 118.028848, 118.034421, 118.04072, 118.041932, 118.042659, 118.045082, 118.04702, 118.049201, 118.05114, 118.053321, 118.055017, 118.056229, 118.057198, 118.059379, 118.060349, 118.061076, 118.062045, 118.068105, 118.073437, 118.118294, 119.053944, 119.054925, 119.055662, 119.619939, 124.749714, 127.159604, 127.943704, 129.675151, 134.047025, 134.572542, 134.819748, 136.917755, 139.460066, 140.385981, 140.621972, 143.974945, 144.024242, 144.180789, 148.374734, 148.952117, 148.953491, 149.796126, 151.982569, 154.02709, 154.029257, 154.393233, 158.030345, 159.034987, 160.019023, 160.2426, 160.841358, 162.014693, 162.218263, 162.257304, 162.838737, 171.969375, 172.977601, 172.988347, 173.985614, 174.007729, 174.918078, 178.005631, 179.063864, 179.274556, 179.977276, 179.979101, 184.345983, 184.415989, 187.7037, 188.013575, 190.673064, 192.927839, 193.993403, 197.987839, 202.002201, 202.944414, 202.987572, 203.028011, 203.229294, 203.231483, 209.935171, 209.943217, 212.003681, 215.060822, 215.953807, 215.995184, 216.505872, 217.974656, 219.9753, 221.358208, 226.559669, 227.614808, 232.040107, 232.042778, 232.924121, 237.102586, 237.104656, 237.108105, 237.112243, 237.114313, 237.995598, 237.99976, 238.111484, 239.249141, 239.97512, 243.98882, 244.448855, 244.978999, 244.981173, 244.985519, 245.919835, 248.959045, 250.050619, 252.609279, 253.030032, 253.91368, 257.706655, 259.083878, 259.090181, 259.097272, 260.093737, 261.046549, 261.052924, 261.060096, 261.066471, 261.070456, 261.073644, 261.079223, 261.086396, 262.069519, 271.985698, 273.048982, 275.054668, 275.064149, 275.879583, 275.964444, 279.029852, 280.028481, 281.02536, 281.02892, 281.072539, 282.027572, 285.042035, 286.696696, 288.024725, 289.03215, 290.012208, 290.019673, 290.024339, 290.029005, 291.027274, 291.035716, 292.030706, 292.890598, 293.027965, 299.035195, 299.04008, 299.736922, 299.92427, 300.036174, 321.017311, 321.060782, 325.995976, 326.007097, 326.992418, 327.00359, 327.993436, 328.003536, 328.008026, 329.001312, 330.053487, 330.736531, 348.985003, 352.953883, 355.138821, 359.001304, 359.014156, 372.336295, 372.567159, 373.022725, 376.672666, 377.012665, 378.036816, 378.135432, 381.127404, 386.938306, 393.009685, 394.113057, 395.115707, 397.948672, 400.12935, 401.082209, 402.193868, 408.010441, 408.089863, 409.077568, 409.086948, 410.072001, 410.086122, 414.691831, 417.888382, 418.07082, 422.064065, 426.129752, 430.010087, 431.05988, 434.029065, 434.042732, 458.754924, 459.880116, 462.09979, 462.998185, 464.004933, 469.280275, 470.020605, 478.073753, 478.920132, 498.973703, 499.182243, 499.218066, 500.186747, 520.995992, 529.549884, 535.154021, 551.124594, 552.09386, 552.947752, 553.102547, 553.830712, 559.360569, 574.643272, 575.521335, 583.062823, 604.035273, 605.043439, 619.112451, 620.018584, 683.359435, 686.148952, 746.183337, 809.120249, 833.44492, 840.163136, 843.161748, 874.134744, 902.917293, 912.064234, 957.563442, 1006.976678, 1065.994028, 1071.181276, 1106.966746, 1107.969421, 1131.232445, 1165.985321, 1166.986407, 1206.962121, 1208.706876, 1257.957211, 1266.982865, 1267.988864, 1305.953902, 1306.953119, 1334.961032, 1366.97704, 1434.963914, 1456.818092, 1466.966411,
Processing time: 0:00:00.396994
Queried mass list: ['100.040', '102.711', '104.802', '107.492', '109.970', '112.984', '115.234', '117.925']

Queried mass	Num. matched formulas	Num. matched fragments
100.04028 (link to fragments)	2	4
102.711442 (link to fragments)	2	4
104.802119 (link to fragments)	2	2
107.491986	No match found!	No match found!
109.969933 (link to fragments)	1	1
112.983832 (link to fragments)	1	1
115.233654 (link to fragments)	1	1
117.925229 (link to fragments)	1	1