Fig. Icalibration Curves of Sixvalidation Standards Were Constructed at Six Concentration

Fig. Icalibration Curves of Sixvalidation Standards Were Constructed at Six Concentration

SupplementalData

Fig. ICalibration curves of sixvalidation standards were constructed at six concentration levels (C1-C6: 0.01, 0.02, 0.1, 0.2, 1, 2 µg/ml) and the average peakarea oftriplicate measurements at eachconcentration level was calculated from the extracted ionchromatograms. A: PG(14:0/14:0); B: PE(14:0/14:0), C: PC(14:1/14:1); D: SPE(d17:0/12:0); E: LPG(17:1); F: LPE(17:1).

Table I721 lipid species, 415 identified by targeted MS/MS and 306 by highly accurate masses, were detected in rat peritoneal surface layers by our 2D-LC-MS method. Information on six exogenous lipids (validation standards, VS), was listed in this table as well.Lipids containing choline (PC, SM, and LPC) were best detected as [M+HCOO-]- and other lipids (PI, PG, PE, PS, FFA, LPI, LPG, LPE and LPS) were obtained with [M-H+]- as the molecular ions in negative mode.

[M-H+]-
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PI / 32:1 / 46.437 / 807.5029 / 807.5029 / 0.0 / -
32:0 / 47.130 / 809.5198 / 809.5186 / 1.5 / -
34:3 / 46.130 / 831.5015 / 831.5029 / -1.7 / -
34:2 / 46.679 / 833.5192 / 833.5186 / 0.8 / 16:0/18:2,16:1/18:1
34:1 / 47.437 / 835.5345 / 835.5342 / 0.4 / 16:0/18:1,16:1/18:0
34:0 / 48.276 / 837.5491 / 837.5499 / -0.9 / -
35:2 / 47.243 / 847.5337 / 847.5342 / -0.6 / -
35:1 / 48.017 / 849.5508 / 849.5499 / 1.1 / -
36:5 / 46.017 / 855.5020 / 855.5029 / -1.1 / 16:0/20:5,16:1/20:4
36:4 / 46.711 / 857.5206 / 857.5186 / 2.4 / 16:0/20:4,18:2/18:2,18:1/18:3
36:3 / 47.050 / 859.5342 / 859.5342 / 0.0 / 16:0/20:3,18:1/18:2
36:2 / 47.856 / 861.5519 / 861.5499 / 2.4 / 18:0/18:2,18:1/18:1
36:1 / 48.663 / 863.5662 / 863.5655 / 0.8 / 18:0/18:1
36:0 / 49.259 / 865.5798 / 865.5812 / -1.6 / -
38:7 / 45.743 / 879.5017 / 879.5029 / -1.4 / -
38:6 / 46.550 / 881.5199 / 881.5186 / 1.5 / 16:0/22:6,18:2/20:4,18:1/20:5
38:5 / 47.163 / 883.5367 / 883.5342 / 2.8 / 16:0/22:5,18:1/20:4,18:0/20:5
38:4 / 47.905 / 885.5516 / 885.5499 / 2.0 / 16:0/22:4,18:0/20:4
38:3 / 48.453 / 887.5650 / 887.5655 / -0.6 / -
38:2 / 48.824 / 889.5790 / 889.5812 / -2.4 / -
38:1 / 49.695 / 891.5949 / 891.5968 / -2.1 / -
40:8 / 46.372 / 905.5196 / 905.5186 / 1.2 / -
40:7 / 47.098 / 907.5342 / 907.5342 / 0.0 / -
40:6 / 47.679 / 909.5500 / 909.5499 / 0.2 / 18:0/22:6,18:1/22:5
40:5 / 48.130 / 911.5668 / 911.5655 / 1.4 / 18:1/22:4,18:0/22:5
40:4 / 48.872 / 913.5825 / 913.5812 / 1.5 / 18:0/22:4,18:2/22:3
42:6 / 48.501 / 937.5827 / 937.5812 / 1.6 / -
42:5 / 49.130 / 939.5978 / 939.5968 / 1.1 / -
42:4 / 49.759 / 941.6107 / 941.6125 / -1.9 / -
O-34:4 / 47.582 / 815.5057 / 815.5080 / -2.8 / -
O-36:4 / 47.421 / 843.5392 / 843.5393 / -0.1 / -
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PI / O-38:5 / 47.663 / 869.5533 / 869.5549 / -1.9 / O-16:0/22:5,O-18:1/20:4
O-38:4 / 48.582 / 871.5695 / 871.5706 / -1.2 / -
O-40:6 / 47.937 / 895.5705 / 895.5706 / -0.1 / -
O-40:5 / 48.727 / 897.5872 / 897.5862 / 1.1 / -
O-40:4 / 49.421 / 899.6000 / 899.6019 / -2.1 / -
LPI / 15:0 / 88.534 / 557.2748 / 557.2732 / 2.9 / -
16:0 / 88.793 / 571.2898 / 571.2889 / 1.6 / -
18:2 / 88.631 / 595.2890 / 595.2889 / 0.2 / -
18:1 / 88.986 / 597.3030 / 597.3045 / -2.5 / -
18:0 / 89.422 / 599.3203 / 599.3202 / 0.2 / -
20:4 / 88.631 / 619.2889 / 619.2889 / 0.0 / -
22:6 / 88.664 / 643.2896 / 643.2889 / 1.1 / -
PG / 28:0 (VS) / 44.808 / 665.4390 / 665.4399 / -1.4 / 14:0/14:0
30:0 / 46.098 / 693.4706 / 693.4712 / -0.9 / -
32:1 / 46.453 / 719.4858 / 719.4869 / -1.5 / -
32:0 / 47.227 / 721.5026 / 721.5025 / 0.1 / -
33:0 / 47.275 / 735.5189 / 735.5182 / 1.0 / 16:0/17:0
34:2 / 46.824 / 745.5025 / 745.5025 / 0.0 / -
34:1 / 47.550 / 747.5195 / 747.5182 / 1.8 / 16:0/18:1
34:0 / 48.388 / 749.5344 / 749.5338 / 0.8 / -
35:1 / 48.114 / 761.5356 / 761.5338 / 2.4 / -
36:4 / 46.872 / 769.5027 / 769.5025 / 0.2 / -
36:3 / 47.308 / 771.5180 / 771.5182 / -0.2 / -
36:2 / 47.985 / 773.5346 / 773.5338 / 1.0 / -
36:1 / 48.759 / 775.5497 / 775.5495 / 0.3 / -
38:5 / 47.275 / 795.5182 / 795.5182 / 0.1 / -
38:4 / 48.050 / 797.5334 / 797.5338 / -0.5 / -
38:3 / 48.421 / 799.5506 / 799.5495 / 1.4 / -
40:8 / 45.485 / 817.5026 / 817.5025 / 0.1 / -
40:7 / 46.259 / 819.5197 / 819.5182 / 1.9 / -
42:10 / 45.469 / 841.5015 / 841.5025 / -1.2 / -
44:12 / 45.308 / 865.5005 / 865.5025 / -2.3 / -
44:11 / 45.679 / 867.5167 / 867.5182 / -1.7 / -
LPG / 14:0 / 39.243 / 455.2421 / 455.2415 / 1.3 / -
15:0 / 39.63 / 469.2569 / 469.2572 / -0.6 / -
16:1 / 39.566 / 481.2571 / 481.2572 / -0.2 / -
16:0 / 39.953 / 483.2730 / 483.2728 / 0.4 / -
17:1 (VS) / 39.84 / 495.2733 / 495.2728 / 1.0 / 17:1/0:0
17:0 / 40.372 / 497.2883 / 497.2885 / -0.4 / -
18:2 / 39.646 / 507.2726 / 507.2728 / -0.4 / -
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
18:1 / 40.082 / 509.2889 / 509.2885 / 0.8 / -
18:0 / 40.808 / 511.3043 / 511.3041 / 0.4 / -
20:4 / 39.662 / 531.2726 / 531.2728 / -0.4 / -
20:3 / 39.904 / 533.2883 / 533.2885 / -0.4 / -
20:2 / 40.308 / 535.3050 / 535.3041 / 1.7 / -
22:6 / 39.63 / 555.2718 / 555.2728 / -1.8 / 22:6/0:0
22:5 / 39.937 / 557.2882 / 557.2885 / -0.5 / -
22:4 / 40.211 / 559.3053 / 559.3041 / 2.1 / -
PE / 28:0 (VS) / 64.308 / 634.4470 / 634.4453 / 2.6 / 14:0/14:0
30:0 / 66.244 / 662.4761 / 662.4766 / -0.8 / -
32:2 / 65.582 / 686.4761 / 686.4766 / -0.8 / -
32:1 / 66.970 / 688.4939 / 688.4923 / 2.4 / 16:0/16:1
32:0 / 68.437 / 690.5083 / 690.5079 / 0.5 / 16:0/16:0
33:2 / 66.615 / 700.4942 / 700.4923 / 2.7 / -
33:1 / 68.147 / 702.5072 / 702.5079 / -1.0 / -
33:0 / 69.728 / 704.5243 / 704.5236 / 1.0 / -
34:4 / 65.582 / 710.4753 / 710.4766 / -1.9 / -
34:3 / 66.308 / 712.4937 / 712.4923 / 2.0 / 16:1/18:2
34:2 / 67.728 / 714.5085 / 714.5079 / 0.8 / 16:0/18:2
34:1 / 69.324 / 716.5240 / 716.5236 / 0.6 / 16:0/18:1
34:0 / 71.050 / 718.5391 / 718.5392 / -0.2 / 16:0/18:0
35:4 / 66.615 / 724.4903 / 724.4923 / -2.7 / -
35:3 / 67.341 / 726.5080 / 726.5089 / -1.3 / -
35:2 / 68.921 / 728.5249 / 728.5236 / 1.8 / 17:0/18:2
35:1 / 70.599 / 730.5386 / 730.5392 / -0.9 / 17:0/18:1
36:6 / 65.131 / 734.4763 / 734.4766 / -0.4 / -
36:5 / 66.421 / 736.4937 / 736.4923 / 1.9 / 16:1/20:4,16:0/20:5
36:4 / 67.744 / 738.5084 / 738.5079 / 0.6 / 18:2/18:2,16:0/20:4,18:1/18:3
36:3 / 68.518 / 740.5246 / 740.5236 / 1.4 / 18:2/18:1,16:0/20:3
36:2 / 70.262 / 742.5409 / 742.5392 / 2.3 / 16:0/20:2,18:0/18:2,18:1/18:1
36:1 / 71.945 / 744.5567 / 744.5549 / 2.4 / 18:1/18:0
37:5 / 67.341 / 750.5096 / 750.5079 / 2.2 / -
37:4 / 68.986 / 752.5243 / 752.5236 / 1.0 / -
37:3 / 69.824 / 754.5378 / 754.5392 / -1.9 / -
37:2 / 71.631 / 756.5548 / 756.5549 / -0.1 / 17:0/20:2
37:1 / 73.244 / 758.5696 / 758.5705 / -1.2 / 17:0/20:1
38:7 / 66.050 / 760.4922 / 760.4923 / -0.1 / 16:1/22:6
38:6 / 67.453 / 762.5087 / 762.5079 / 1.0 / 16:1/22:5,16:0/22:6,18:2/20:4,18:1/20:5
38:5 / 68.502 / 764.5240 / 764.5236 / 0.6 / 16:1/22:4,16:0/22:5,18:2/20:3,18:1/20:4
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PE / 38:4 / 70.292 / 766.5401 / 766.5392 / 1.1 / 16:0/22:4,18:0/20:4,18:1/20:3,18:2/20:2,
18:3/20:1
38:3 / 71.195 / 768.5549 / 768.5549 / 0.0 / 16:0/22:3,18:0/20:3,18:1/20:2
38:2 / 72.631 / 770.5711 / 770.5705 / 0.7 / 18:0/20:2,18:1/20:1
38:1 / 74.583 / 772.5856 / 772.5862 / -0.7 / 18:0/20:1
39:6 / 68.695 / 776.5234 / 776.5236 / -0.2 / -
39:5 / 69.679 / 778.5396 / 778.5392 / 0.5 / -
39:4 / 71.615 / 780.5555 / 780.5549 / 0.8 / -
39:3 / 72.566 / 782.5691 / 782.5705 / -1.8 / -
40:8 / 66.792 / 786.5091 / 786.5079 / 1.5 / 18:2/22:6
40:7 / 68.228 / 788.5236 / 788.5236 / 0.0 / 18:2/22:5,18:1/22:6
40:6 / 69.953 / 790.5373 / 790.5392 / -2.4 / 16:0/24:6,18:1/22:5,18:0/22:6
40:5 / 70.695 / 792.5548 / 792.5549 / -0.1 / 18:1/22:4,18:0/22:5,20:2/20:3,20:1/20:4
40:4 / 72.260 / 794.5710 / 794.5705 / 0.6 / 16:0/24:4,18:0/22:4,18:3/20:1,20:0/20:4
40:3 / 73.954 / 796.5843 / 796.5862 / -2.4 / -
40:2 / 75.421 / 798.6020 / 798.6018 / 0.2 / 18:0/22:2,20:0/20:2
40:1 / 76.970 / 800.6177 / 800.6175 / 0.3 / 18:1/22:0,18:0/22:1
41:6 / 71.244 / 804.5547 / 804.5549 / -0.2 / -
41:5 / 72.018 / 806.5723 / 806.5705 / 2.2 / -
41:4 / 73.663 / 808.5854 / 808.5862 / -1.0 / -
42:5 / 73.357 / 820.5860 / 820.5862 / -0.2 / 18:0/24:5
42:4 / 74.550 / 822.6006 / 822.6018 / -1.5 / 18:0/24:4
42:3 / 76.196 / 824.6169 / 824.6175 / -0.7 / 18:0/24:3,18:2/24:1,18:1/24:2
42:2 / 77.147 / 826.6333 / 826.6331 / 0.2 / -
42:1 / 77.921 / 828.6491 / 828.6488 / 0.4 / -
44:5 / 76.325 / 848.6171 / 848.6175 / -0.4 / 22:1/22:4,20:4/24:1
44:4 / 77.357 / 850.6319 / 850.6331 / -1.4 / -
O-32:2 / 68.341 / 672.4971 / 672.4974 / -0.4 / -
O-32:1 / 70.018 / 674.5128 / 674.5130 / -0.3 / 14:0/18:1,16:1/16:0
O-33:2 / 69.518 / 686.5117 / 686.5130 / -1.9 / -
O-34:5 / 66.760 / 694.4811 / 694.4817 / -0.9 / -
O-34:4 / 67.937 / 696.4989 / 696.4974 / 2.2 / -
O-34:3 / 69.195 / 698.5122 / 698.5130 / -1.2 / 16:1/18:2,16:0/18:3
O-34:2 / 70.857 / 700.5303 / 700.5287 / 2.3 / 16:0/18:2
O-34:1 / 72.647 / 702.5454 / 702.5443 / 1.5 / 16:1/18:0,16:0/18:1,
O-35:5 / 67.889 / 708.4976 / 708.4974 / 0.3 / -
O-35:3 / 70.502 / 712.5283 / 712.5297 / -1.9 / -
O-35:2 / 72.163 / 714.5436 / 714.5443 / -1.0 / -
O-36:5 / 69.147 / 722.5140 / 722.5130 / 1.4 / -
O-36:4 / 70.034 / 724.5281 / 724.5287 / -0.8 / -
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PE / O-36:3 / 71.647 / 726.5444 / 726.5443 / 0.1 / 18:3/18:0,16:0/20:3,18:2/18:1
O-36:2 / 73.583 / 728.5602 / 728.5600 / 0.3 / 18:0/18:2,18:1/18:1,16:0/20:2
O-36:1 / 75.631 / 730.5752 / 730.5756 / -0.6 / -
O-37:6 / 68.792 / 734.5136 / 734.5130 / 0.8 / -
O-37:5 / 70.437 / 736.5293 / 736.5287 / 0.9 / -
O-38:8 / 66.873 / 744.4980 / 744.4974 / 0.9 / -
O-38:7 / 68.776 / 746.5140 / 746.5130 / 1.3 / 16:1/22:6,18:2/20:5
O-38:6 / 69.857 / 748.5285 / 748.5287 / -0.2 / 16:1/22:5,16:0/22:6,18:2/20:4,18:1/20:5,18:3/20:3
O-38:5 / 71.776 / 750.5462 / 750.5443 / 2.5 / -
O-38:4 / 72.744 / 752.5599 / 752.5600 / -0.1 / -
O-38:3 / 74.373 / 754.5748 / 754.5756 / -1.1 / 16:0/22:3,18:1/20:2,18:3/20:0,18:2/20:1,18:0/20:3
O-38:2 / 76.163 / 756.5912 / 756.5913 / -0.1 / 16:0/22:2,18:2/20:0,18:1/20:1,18:0/20:2
O-38:1 / 77.244 / 758.6089 / 758.6069 / 2.6 / -
O-39:8 / 68.389 / 758.5111 / 758.5130 / -2.5 / -
O-39:7 / 70.066 / 760.5294 / 760.5287 / 1.0 / -
O-39:6 / 71.147 / 762.5429 / 762.5443 / -1.9 / 17:0/22:6
O-39:5 / 72.825 / 764.5596 / 764.5600 / -0.5 / -
O-40:10 / 66.744 / 768.4993 / 768.4974 / 2.5 / -
O-40:9 / 67.986 / 770.5139 / 770.5130 / 1.1 / 18:3/22:6,20:5/20:4
O-40:8 / 69.518 / 772.5289 / 772.5287 / 0.3 / 18:2/22:6,20:5/20:3
O-40:7 / 71.405 / 774.5448 / 774.5443 / 0.6 / 18:2/22:5,18:1/22:6,20:4/20:3,20:5/20:2
O-40:6 / 72.195 / 776.5607 / 776.5600 / 0.9 / 16:0/24:6,18:2/22:4,18:1/22:5,18:0/22:6,20:4/20:2
O-40:5 / 73.825 / 778.5754 / 778.5756 / -0.3 / 16:0/24:5,18:1/22:4,18:0/22:5,20:1/20:4,20:0/20:5
O-40:4 / 75.502 / 780.5895 / 780.5913 / -2.3 / -
O-40:3 / 76.647 / 782.6083 / 782.6069 / 1.8 / 16:0/24:3,18:2/22:1,18:1/22:2,18:0/22:3,20:0/20:3
O-42:10 / 68.728 / 796.5284 / 796.5287 / -0.3 / -
O-42:9 / 70.276 / 798.5440 / 798.5443 / -0.4 / -
O-42:8 / 71.389 / 800.5590 / 800.5600 / -1.2 / 20:2/22:6
O-42:7 / 73.276 / 802.5760 / 802.5756 / 0.5 / -
O-42:6 / 74.873 / 804.5918 / 804.5913 / 0.7 / -
O-42:5 / 76.131 / 806.6076 / 806.6069 / 0.9 / -
O-42:4 / 77.034 / 808.6215 / 808.6226 / -1.3 / 16:0/26:4,20:3/22:1,20:1/22:3,20:0/22:4
O-44:7 / 76.002 / 830.6079 / 830.6069 / 1.2 / -
O-44:6 / 77.050 / 832.6225 / 832.6226 / -0.1 / -
O-45:8 / 76.115 / 842.6060 / 842.6069 / -1.1 / -
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PE / O-45:7 / 77.276 / 844.6242 / 844.6226 / 1.9 / -
SPE / d17:1/12:0
(VS) / 62.082 / 589.4351 / 589.4364 / -2.2 / d17:1/12:0
LPE / 14:0 / 88.857 / 424.2478 / 424.2469 / 2.1 / 14:0/0:0
15:0 / 89.164 / 438.2630 / 438.2626 / 0.9 / -
16:1 / 89.067 / 450.2630 / 450.2626 / 0.9 / 16:1/0:0
16:0 / 89.551 / 452.2785 / 452.2782 / 0.7 / 16:0/0:0
17:1(VS) / 89.422 / 464.2790 / 464.2782 / 1.7 / 17:1/0:0
17:0 / 89.970 / 466.2943 / 466.2939 / 0.9 / 17:0/0:0
18:3 / 89.002 / 474.2617 / 474.2626 / -1.9 / -
18:2 / 89.325 / 476.2774 / 476.2782 / -1.7 / 18:2/0:0
18:1 / 89.841 / 478.2949 / 478.2939 / 2.1 / 18:1/0:0
18:0 / 90.454 / 480.3101 / 480.3095 / 1.2 / 18:0/0:0
19:1 / 90.276 / 492.3093 / 492.3095 / -0.4 / -
19:0 / 91.018 / 494.3254 / 494.3252 / 0.4 / -
20:5 / 88.954 / 498.2630 / 498.2626 / 0.8 / -
20:4 / 89.325 / 500.2791 / 500.2782 / 1.8 / -
20:3 / 89.631 / 502.2940 / 502.2939 / 0.2 / -
20:1 / 90.744 / 506.3259 / 506.3252 / 1.4 / -
22:6 / 89.293 / 524.2793 / 524.2782 / 2.1 / 22:6/0:0
22:5 / 89.535 / 526.2929 / 526.2939 / -1.9 / -
22:4 / 89.793 / 528.3101 / 528.3095 / 1.1 / -
22:0 / 92.551 / 536.3727 / 536.3721 / 1.1 / -
24:1 / 92.760 / 562.3878 / 562.3878 / 0.0 / -
24:0 / 93.244 / 564.4042 / 564.4034 / 1.4 / -
O-15:1 / 89.465 / 422.2676 / 422.2677 / -0.2 / -
O-16:2 / 89.400 / 434.2675 / 434.2677 / -0.4 / -
O-16:1 / 90.018 / 436.2844 / 436.2834 / 2.3 / O-16:1/0:0
O-17:1 / 90.518 / 450.2995 / 450.2990 / 1.2 / -
O-18:3 / 89.760 / 460.2833 / 460.2834 / -0.2 / -
O-18:2 / 90.309 / 462.2994 / 462.2990 / 0.9 / O-18:2/0:0
O-18:1 / 91.051 / 464.3141 / 464.3147 / -1.2 / O-18:1/0:0
O-19:1 / 91.449 / 478.3298 / 478.3303 / -1.0 / -
O-20:3 / 90.696 / 488.3150 / 488.3147 / 0.7 / -
O-20:2 / 91.357 / 490.3298 / 490.3303 / -1.0 / -
O-20:1 / 92.212 / 492.3464 / 492.3460 / 0.9 / -
O-22:1 / 92.938 / 520.3764 / 520.3773 / -1.7 / -
PS / 29:0 / 93.131 / 692.4501 / 692.4508 / -1.0 / -
30:0 / 93.389 / 706.4672 / 706.4665 / 1.1 / -
32:2 / 93.196 / 730.4669 / 730.4665 / 0.6 / -
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PS / 32:1 / 93.422 / 732.4811 / 732.4821 / -1.4 / 14:0/18:1,16:1/16:0
32:0 / 93.696 / 734.4973 / 734.4978 / -0.6 / 14:0/18:0,16:0/16:0
33:1 / 93.647 / 746.4987 / 746.4978 / 1.3 / -
33:0 / 93.825 / 748.5137 / 748.5134 / 0.4 / -
34:3 / 93.325 / 756.4823 / 756.4821 / 0.3 / 14:0/20:3,16:1/18:2,16:0/18:3
34:2 / 93.583 / 758.4980 / 758.4978 / 0.3 / 14:0/20:2,16:0/18:2,16:1/18:1
34:1 / 93.744 / 760.5150 / 760.5134 / 2.1 / 16:1/18:0,16:0/18:1
34:0 / 94.131 / 762.5295 / 762.5291 / 0.6 / 16:0/18:0
35:2 / 93.696 / 772.5138 / 772.5134 / 0.5 / 17:0/18:2
35:1 / 94.083 / 774.5280 / 774.5291 / -1.4 / -
36:5 / 93.454 / 780.4817 / 780.4821 / -0.5 / 14:0/22:5,16:1/20:4,16:0/20:5,18:3/18:2
36:4 / 93.535 / 782.4984 / 782.4978 / 0.8 / 14:0/22:4,16:1/20:3,16:0/20:4,18:3/18:1,18:2/18:2
36:3 / 93.696 / 784.5128 / 784.5134 / -0.8 / 16:0/20:3,16:1/20:2,18:3/18:0,18:1/18:2
36:2 / 94.002 / 786.5305 / 786.5291 / 1.8 / 16:1/20:1,16:0/20:2,18:1/18:1,18:2/18:0
36:1 / 94.341 / 788.5437 / 788.5447 / -1.3 / 16:0/20:1, 18:1/18:0
37:4 / 93.696 / 796.5145 / 796.5134 / 1.4 / 17:0/20:4
37:3 / 93.777 / 798.5285 / 798.5291 / -0.7 / 17:0/20:3
37:1 / 94.648 / 802.5598 / 802.5604 / -0.7 / -
38:7 / 93.212 / 804.4823 / 804.4821 / 0.2 / -
38:6 / 93.502 / 806.4982 / 806.4978 / 0.5 / 16:1/22:5,16:0/22:6,18:2/20:4,18:1/20:5
38:5 / 93.680 / 808.5134 / 808.5134 / 0.0 / 16:1/22:4,16:0/22:5, 18:3/20:2,18:2/20:3,18:1/20:4,18:0/20:5
38:4 / 93.986 / 810.5308 / 810.5291 / 2.1 / 16:0/22:4,18:3/20:1,18:2/20:2,18:1/20:3,18:0/20:4
38:3 / 94.115 / 812.5444 / 812.5447 / -0.4 / 18:3/20:0,18:2/20:1,18:1/20:2,18:0/20:3
38:2 / 94.567 / 814.5597 / 814.5604 / -0.8 / -
38:1 / 95.018 / 816.5759 / 816.5760 / -0.1 / 16:1/22:0,16:0/22:1,18:1/20:0,18:0/20:1
39:6 / 93.680 / 820.5140 / 820.5134 / 0.7 / 17:0/22:6
39:5 / 93.744 / 822.5300 / 822.5291 / 1.1 / -
39:4 / 94.148 / 824.5460 / 824.5447 / 1.6 / -
39:1 / 95.260 / 830.5896 / 830.5917 / -2.5 / -
40:9 / 93.422 / 828.4819 / 828.4821 / -0.3 / -
40:8 / 93.373 / 830.4978 / 830.4978 / 0.1 / 18:2/22:6,20:4/20:4
40:7 / 93.551 / 832.5132 / 832.5134 / -0.2 / 16:1/24:6,18:3/22:4,18:2/22:5,18:1/22:6,20:3/20:4
40:6 / 93.793 / 834.5301 / 834.5291 / 1.2 / 16:0/24:6,18:2/22:4,18:1/22:5,18:0/22:6,20:5/20:1,20:4/20:2,20:3/20:3
40:5 / 94.099 / 836.5452 / 836.5447 / 0.6 / 16:0/24:5,18:3/22:2,18:1/22:4,18:0/22:5,20:4/20:1,20:3/20:2
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PS / 40:4 / 94.406 / 838.5611 / 838.5604 / 0.9 / 16:0/24:4,18:2/22:2,18:0/22:4,20:4/20:0,20:3/20:1,20:2/20:2
40:2 / 95.186 / 842.5928 / 842.5917 / 1.4 / -
41:6 / 94.083 / 848.5443 / 848.5447 / -0.5 / -
41:5 / 94.180 / 850.5594 / 850.5604 / -1.1 / -
41:4 / 94.744 / 852.5741 / 852.5760 / -2.2 / -
41:3 / 95.212 / 854.5904 / 854.5917 / -1.5 / -
42:9 / 93.422 / 856.5130 / 856.5134 / -0.5 / 20:5/22:4,20:4/22:5,20:3/22:6
42:8 / 93.647 / 858.5290 / 858.5291 / -0.1 / -
42:7 / 93.744 / 860.5441 / 860.5447 / -0.7 / -
42:6 / 94.148 / 862.5611 / 862.5604 / 0.9 / 18:2/24:4,18:1/24:4,18:0/24:6,20:3/22:3,20:2/22:4,20:1/22:5,20:0/22:6
42:5 / 94.648 / 864.5761 / 864.5760 / 0.1 / 18:3/24:2,18:2/24:3,18:1/24:4,18:0/24:5,20:4/22:1,20:1/22:4,20:0/22/5
42:4 / 94.938 / 866.5916 / 866.5917 / -0.1 / 18:3/24:1,18:2/24:2,18:1/24:3,18:0/24:4,20:3/22:1,20:1/22:3,20:0/22:4
42:3 / 95.325 / 868.6058 / 868.6073 / -1.7 / -
42:2 / 96.777 / 870.6241 / 870.6230 / 1.3 / -
42:1 / 96.873 / 872.6368 / 872.6386 / -2.1 / -
44:11 / 93.389 / 880.5125 / 880.5134 / -1.0 / -
44:10 / 93.615 / 882.5282 / 882.5291 / -1.0 / -
O-33:4 / 93.777 / 726.4703 / 726.4715 / -1.7 / -
O-34:2 / 94.115 / 744.5184 / 744.5185 / -0.1 / -
O-34:1 / 94.099 / 746.5323 / 746.5341 / -2.5 / -
O-36:4 / 93.712 / 768.5184 / 768.5185 / -0.1 / -
O-36:3 / 94.131 / 770.5332 / 770.5341 / -1.2 / -
O-38:6 / 93.777 / 792.5206 / 792.5185 / 2.7 / -
O-38:5 / 94.164 / 794.5345 / 794.5341 / 0.4 / -
LPS / 18:2 / 89.597 / 520.2686 / 520.2681 / 1.0 / 18:2/0:0
18:0 / 90.615 / 524.2991 / 524.2994 / -0.6 / -
20:4 / 89.325 / 544.2670 / 544.2681 / -2.0 / -
20:3 / 89.841 / 546.2821 / 546.2837 / -2.9 / -
20:2 / 90.470 / 548.3000 / 548.2994 / 1.1 / -
21:1 / 89.309 / 564.3311 / 564.3307 / 0.7 / -
FFA / 14:1 / 14.613 / 225.1861 / 225.1861 / 0.0 / -
14:0 / 16.420 / 227.2022 / 227.2017 / 2.2 / -
15:1 / 16.372 / 239.2019 / 239.2017 / 0.8 / -
15:0 / 18.501 / 241.2173 / 241.2173 / 0.0 / -
16:2 / 15.775 / 251.2019 / 251.2017 / 0.8 / -
16:1 / 17.936 / 253.2179 / 253.2173 / 2.4 / -
Lipid Class / Lipid species / Retention time / Molecular ion [M-H+]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
FFA / 16:0 / 21.178 / 255.2335 / 255.2330 / 2.0 / -
17:1 / 20.452 / 267.2326 / 267.2330 / -1.5 / -
17:0 / 22.888 / 269.2490 / 269.2486 / 1.5 / -
18:3 / 17.210 / 277.2176 / 277.2173 / 1.1 / -
18:2 / 19.888 / 279.2332 / 279.2330 / 0.7 / -
18:1 / 22.517 / 281.2489 / 281.2486 / 1.1 / -
18:0 / 23.533 / 283.2643 / 283.2643 / 0.0 / -
19:1 / 23.323 / 295.2647 / 295.2643 / 1.4 / -
19:0 / 24.149 / 297.2800 / 297.2799 / 0.3 / -
20:5 / 17.291 / 301.2172 / 301.2173 / -0.3 / -
20:4 / 19.888 / 303.2333 / 303.2330 / 1.0 / -
20:3 / 22.164 / 305.2486 / 305.2486 / 0.0 / -
20:2 / 23.114 / 307.2648 / 307.2643 / 1.6 / -
20:1 / 23.920 / 309.2800 / 309.2799 / 0.3 / -
20:0 / 24.823 / 311.2960 / 311.2956 / 1.3 / -
21:5 / 19.259 / 315.2332 / 315.2327 / 1.6 / -
21:4 / 22.017 / 317.2487 / 317.2484 / 0.9 / -
21:3 / 23.097 / 319.2640 / 319.2641 / -0.3 / -
21:1 / 24.194 / 323.2955 / 323.2955 / 0.0 / -
21:0 / 24.420 / 325.3111 / 325.3112 / -0.3 / -
22:6 / 19.355 / 327.2335 / 327.2330 / 1.5 / -
22:5 / 21.404 / 329.2482 / 329.2486 / -1.2 / -
22:4 / 22.952 / 331.2646 / 331.2643 / 0.9 / -
22:3 / 23.694 / 333.2803 / 333.2798 / 1.5 / -
22:2 / 24.356 / 335.2957 / 335.2956 / 0.3 / -
22:1 / 25.081 / 337.3113 / 337.3112 / 0.3 / -
22:0 / 25.904 / 339.3267 / 339.3269 / -0.6 / -
24:6 / 22.888 / 355.2643 / 355.2640 / 0.8 / -
24:5 / 23.565 / 357.2801 / 357.2797 / 1.1 / -
24:4 / 24.056 / 359.2956 / 359.2954 / 0.6 / -
24:3 / 24.807 / 361.3114 / 361.3111 / 0.8 / -
24:2 / 25.872 / 363.3262 / 363.3268 / -1.7 / -
24:1 / 26.339 / 365.3427 / 365.3425 / 0.5 / -
24:0 / 27.243 / 367.3586 / 367.3582 / 1.1 / -
[M+HCOO-]-
Lipid Class / Lipid species / Retention time / Molecular ion [M+HCOO-]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PC / 28:2(VS) / 120.309 / 718.4660 / 718.4665 / -0.7 / 14:1/14:1
28:0 / 123.084 / 722.4971 / 722.4978 / -0.9 / -
31:1 / 125.600 / 762.5294 / 762.5291 / 0.4 / -
31:0 / 128.116 / 764.5444 / 764.5447 / -0.4 / -
32:2 / 125.084 / 774.5287 / 774.5291 / -0.5 / -
32:1 / 127.552 / 776.5462 / 776.5447 / 1.9 / 16:1/16:0
32:0 / 130.229 / 778.5619 / 778.5604 / 2.0 / 16:0/16:0
33:2 / 126.955 / 788.5451 / 788.5447 / 0.5 / -
33:1 / 129.632 / 790.5598 / 790.5604 / -0.7 / -
33:0 / 132.777 / 792.5760 / 792.5760 / 0.0 / 16:0/17:0
34:5 / 123.277 / 796.5137 / 796.5134 / 0.3 / -
34:4 / 125.132 / 798.5281 / 798.5291 / -1.2 / 16:1/18:3
34:3 / 126.406 / 800.5451 / 800.5447 / 0.5 / 16:1/18:2,16:0/18:3
34:2 / 128.858 / 802.5620 / 802.5604 / 2.0 / 16:1/18:1,18:2/16:0
34:1 / 131.955 / 804.5765 / 804.5760 / 0.6 / 16:1/18:1
34:0 / 135.423 / 806.5921 / 806.5917 / 0.5 / 17:0/17:0,16:0/18:0
35:4 / 127.019 / 812.5449 / 812.5447 / 0.2 / -
35:3 / 128.487 / 814.5605 / 814.5614 / -1.1 / -
35:2 / 131.374 / 816.5762 / 816.5760 / 0.2 / 17:1/18:1,17:0/18:2
35:1 / 134.536 / 818.5915 / 818.5917 / -0.2 / 17:0/18:1
35:0 / 138.165 / 820.6078 / 820.6073 / 0.6 / -
36:6 / 124.374 / 822.5291 / 822.5291 / 0.0 / -
36:5 / 126.681 / 824.5442 / 824.5447 / -0.6 / 16:1/20:4,16:0/20:5,18:3/18:2
36:4 / 129.052 / 826.5616 / 826.5604 / 1.5 / 16:1/20:3,16:0/20:4,18:2/18:2
36:3 / 130.681 / 828.5760 / 828.5760 / 0.0 / 18:2/18:1,18:1/18:2,16:0/20:3
36:2 / 133.858 / 830.5916 / 830.5917 / -0.1 / 18:0/18:2,18:1/18:1,18:0/18:3
36:1 / 137.326 / 832.6084 / 832.6073 / 1.3 / 16:0/20:1,18:1/18:0
37:5 / 128.326 / 838.5595 / 838.5604 / -1.0 / -
37:4 / 131.455 / 840.5767 / 840.5760 / 0.8 / -
37:3 / 133.213 / 842.5920 / 842.5917 / 0.4 / -
37:2 / 136.681 / 844.6070 / 844.6073 / -0.4 / -
38:7 / 125.439 / 848.5454 / 848.5447 / 0.8 / 18:2/20:5
38:6 / 128.600 / 850.5602 / 850.5604 / -0.2 / 16:0/22:6,18:3/20:3,18:2/20:4
38:5 / 130.553 / 852.5770 / 852.5760 / 1.1 / 16:0/22:5,18:2/20:3,18:1/20:4
38:4 / 134.052 / 854.5926 / 854.5917 / 1.1 / 16:0/22:4,18:2/20:2,18:1/20:3,18:0/20:4
38:3 / 135.971 / 856.6065 / 856.6073 / -1.0 / 18:0/20:3,18:1/20:2
38:2 / 138.842 / 858.6254 / 858.6230 / 2.8 / -
39:6 / 130.929 / 864.5764 / 864.5760 / 0.4 / -
39:5 / 132.923 / 866.5916 / 866.5917 / -0.1 / -
Lipid Class / Lipid species / Retention time / Molecular ion [M+HCOO-]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
PC / 39:4 / 136.197 / 868.6064 / 868.6073 / -1.1 / -
40:9 / 125.213 / 872.5430 / 872.5447 / -2.0 / -
40:8 / 127.571 / 874.5608 / 874.5604 / 0.5 / -
40:7 / 129.987 / 876.5766 / 876.5760 / 0.7 / 18:2/22:5,20:4/20:3
40:6 / 133.519 / 878.5917 / 878.5917 / 0.0 / 16:0/24:6,18:2/22:4,18:1/22:5,18:0/22:6,
20:2/20:4
40:5 / 135.052 / 880.6084 / 880.6073 / 1.2 / 16:0/24:5,18:2/22:3,18:1/22:4,18:0/22:5,
20:3/20:2
40:4 / 138.132 / 882.6239 / 882.6230 / 1.0 / 16:0/24:4,20:2/20:2,20:3/20:1,18:0/22:4
40:3 / 140.681 / 884.6378 / 884.6386 / -0.9 / 18:1/22:2
40:2 / 143.665 / 886.6544 / 886.6543 / 0.1 / -
42:10 / 127.148 / 898.5600 / 898.5604 / -0.4 / -
42:9 / 128.423 / 900.5754 / 900.5760 / -0.7 / 20:4/22:5
42:8 / 131.164 / 902.5924 / 902.5917 / 0.8 / -
42:7 / 133.616 / 904.6078 / 904.6073 / 0.5 / -
42:6 / 135.761 / 906.6223 / 906.6230 / -0.7 / -
42:5 / 139.584 / 908.6380 / 908.6386 / -0.7 / -
42:4 / 142.600 / 910.6537 / 910.6543 / -0.6 / 18:2/24:2,18:0/24:0,20:1/22:3
42:3 / 144.955 / 912.6698 / 912.6699 / -0.1 / 18:1/24:2,18:0/24:3
42:2 / 146.681 / 914.6851 / 914.6856 / -0.5 / 18:2/24:0,18:1/24:1,20:2/22:0
42:1 / 148.552 / 916.6993 / 916.7012 / -2.1 / -
44:11 / 128.100 / 924.5759 / 924.5760 / -0.1 / -
44:10 / 130.487 / 926.5895 / 926.5917 / -2.4 / -
44:9 / 132.600 / 928.6060 / 928.6073 / -1.4 / -
44:8 / 135.632 / 930.6216 / 930.6230 / -1.5 / -
44:6 / 142.616 / 934.6527 / 934.6543 / -1.7 / -
44:5 / 144.971 / 936.6697 / 936.6699 / -0.2 / -
44:4 / 147.262 / 938.6862 / 938.6856 / 0.7 / -
44:2 / 149.165 / 942.7157 / 942.7169 / -1.3 / -
46:5 / 147.729 / 964.6998 / 964.7012 / -1.5 / -
46:4 / 149.246 / 966.7172 / 966.7169 / 0.3 / -
O-30:0 / 128.745 / 736.5509 / 736.5498 / 1.5 / -
O-32:1 / 133.245 / 762.5661 / 762.5655 / 0.8 / 16:1/16:0
O-32:0 / 133.584 / 764.5816 / 764.5811 / 0.6 / 16:0/16:0
O-34:3 / 131.616 / 786.5649 / 786.5655 / -0.7 / 16:1/18:2,16:0/18:3
O-34:1 / 135.197 / 790.5971 / 790.5968 / 0.4 / 16:1/18:0,16:0/18:1
O-34:0 / 139.213 / 792.6122 / 792.6124 / -0.3 / -
O-35:6 / 128.842 / 794.5344 / 794.5342 / 0.3 / -
O-36:6 / 128.842 / 808.5501 / 808.5498 / 0.4 / -
O-36:5 / 131.616 / 810.5652 / 810.5655 / -0.3 / 16:1/20:4,16:0/20:5,18:3/28:2
Lipid Class / Lipid species / Retention time / Molecular ion [M+HCOO-]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
O-36:4 / 132.277 / 812.5814 / 812.5811 / 0.4 / 16:1/20:3,16:0/20:2,18:1/18:3,18:2/18:2
O-36:3 / 133.648 / 814.5964 / 814.5968 / -0.4 / -
O-36:2 / 137.042 / 816.6106 / 816.6124 / -2.2 / -
O-36:1 / 140.713 / 818.6266 / 818.6281 / -1.8 / -
O-36:0 / 144.149 / 820.6414 / 820.6437 / -2.8 / -
O-38:7 / 131.100 / 834.5647 / 834.5655 / -0.9 / -
O-38:6 / 133.148 / 836.5806 / 836.5811 / -0.6 / 16:1/22:5,16:0/22:6,18:3/20:3,18:2/20:4,
18:1/20:5
O-38:5 / 133.729 / 838.5965 / 838.5968 / -0.3 / 16:0/22:5,18:3/20:2,18:2/20:3,18:1/20:4,
18:0/20:5
O-38:4 / 136.310 / 840.6118 / 840.6124 / -0.7 / 16:1/22:3,16:0/22:4,18:3/20:1,18:2/20:2,
18:0/20:4
O-38:2 / 142.245 / 844.6432 / 844.6437 / -0.6 / -
O-38:0 / 143.455 / 848.6749 / 848.6750 / -0.1 / -
O-40:8 / 132.600 / 860.5802 / 860.5811 / -1.1 / -
O-40:7 / 133.245 / 862.5986 / 862.5968 / 2.1 / -
O-40:6 / 134.810 / 864.6128 / 864.6124 / 0.4 / -
O-40:5 / 137.939 / 866.6271 / 866.6281 / -1.1 / 16:0/24:5,18:1/22:4,18:0/22:5,20:4/20:1
O-40:4 / 140.907 / 868.6447 / 868.6437 / 1.1 / 16:0/24:4,18:1/22:3,18:0/22:4
O-42:5 / 143.955 / 894.6590 / 894.6594 / -0.4 / -
O-42:4 / 145.020 / 896.6740 / 896.6750 / -1.1 / -
LPC / 14:1 / 110.212 / 510.2840 / 510.2837 / 0.6 / -
14:0 / 111.261 / 512.3009 / 512.2994 / 2.9 / 14:0/0:0
15:1 / 111.471 / 524.2999 / 524.2994 / 1.0 / -
15:0 / 112.503 / 526.3153 / 526.3150 / 0.6 / 15:0/0:0
16:1 / 112.100 / 538.3149 / 538.3150 / -0.2 / 16:1/0:0
16:0 / 114.084 / 540.3315 / 540.3307 / 1.5 / -
17:1 / 113.551 / 552.3299 / 552.3307 / -1.4 / 17:1/0:0
17:0 / 115.971 / 554.3468 / 554.3463 / 0.9 / 17:0/0:0
18:4 / 110.729 / 560.2990 / 560.2994 / -0.7 / -
18:3 / 111.938 / 562.3153 / 562.3150 / 0.5 / 18:3/0:0
18:2 / 113.180 / 564.3317 / 564.3307 / 1.8 / 18:2/0:0
18:1 / 115.358 / 566.3473 / 566.3463 / 1.8 / 18:1/0:0
18:0 / 116.616 / 568.3625 / 568.3620 / 0.9 / -
19:1 / 116.390 / 580.3626 / 580.3620 / 1.0 / -
19:0 / 117.196 / 582.3776 / 582.3776 / 0.0 / 19:0/0:0
20:5 / 111.825 / 586.3159 / 586.3150 / 1.5 / 20:5/0:0
20:4 / 113.309 / 588.3317 / 588.3307 / 1.7 / 20:4/0:0
20:3 / 114.584 / 590.3459 / 590.3463 / -0.7 / 20:3/0:0
20:2 / 116.213 / 592.3618 / 592.3620 / -0.3 / 20:2/0:0
Lipid Class / Lipid species / Retention time / Molecular ion [M+HCOO-]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
LPC / 20:1 / 116.922 / 594.3782 / 594.3776 / 1.0 / 20:1/0:0
20:0 / 117.858 / 596.3935 / 596.3933 / 0.3 / 20:0/0:0
21:0 / 118.616 / 610.4095 / 610.4089 / 1.0 / -
22:6 / 113.261 / 612.3309 / 612.3307 / 0.3 / 22:6/0:0
22:5 / 114.277 / 614.3467 / 614.3463 / 0.7 / 22:5/0:0
22:4 / 116.051 / 616.3630 / 616.3620 / 1.6 / 22:4/0:0
22:3 / 116.745 / 618.3775 / 618.3776 / -0.2 / -
22:2 / 117.309 / 620.3935 / 620.3933 / 0.3 / -
22:1 / 118.180 / 622.4098 / 622.4089 / 1.4 / -
22:0 / 119.503 / 624.4244 / 624.4246 / -0.3 / 22:0/0:0
23:0 / 120.487 / 638.4412 / 638.4402 / 1.6 / -
24:4 / 117.051 / 644.3947 / 644.3933 / 2.2 / -
24:1 / 119.826 / 650.4409 / 650.4402 / 1.1 / -
24:0 / 121.697 / 652.4562 / 652.4559 / 0.5 / 24:0/0:0
O-16:0 / 116.100 / 526.3511 / 526.3514 / -0.6 / O-16:0/0:0
O-18:2 / 116.438 / 550.3513 / 550.3514 / -0.2 / -
O-18:1 / 116.503 / 552.3670 / 552.3671 / -0.2 / O-18:1/0:0
O-20:2 / 116.906 / 578.3821 / 578.3827 / -1.1 / -
O-20:1 / 117.713 / 580.3974 / 580.3984 / -1.8 / -
O-20:0 / 118.890 / 582.4142 / 582.4140 / 0.3 / -
O-22:1 / 119.245 / 608.4298 / 608.4297 / 0.1 / -
O-22:0 / 120.809 / 610.4453 / 610.4453 / 0.0 / -
O-24:2 / 119.581 / 634.4449 / 634.4453 / -0.7 / -
O-24:0 / 123.242 / 638.4762 / 638.4766 / -0.7 / -
SM(d18:1) / 14:1 / 121.213 / 717.5200 / 717.5189 / 1.5 / -
14:0 / 122.858 / 719.5348 / 719.5345 / 0.4 / d18:1/14:0
15:1 / 122.390 / 731.5330 / 731.5345 / -2.1 / -
15:0 / 124.261 / 733.5507 / 733.5501 / 0.8 / d18:1/15:0
16:1 / 123.745 / 745.5503 / 745.5501 / 0.3 / d18:1/16:1
16:0 / 125.890 / 747.5662 / 747.5657 / 0.7 / d18:1/16:0
16:0 / 127.503 / 749.5822 / 749.5814 / 1.1
17:1 / 125.439 / 759.5653 / 759.5658 / -0.7 / d18:1/17:1
17:0 / 127.939 / 761.5805 / 761.5814 / -1.2 / d18:1/17:0
18:2 / 125.310 / 771.5657 / 771.5657 / 0.0 / -
18:1 / 127.390 / 773.5823 / 773.5814 / 1.2 / d18:1/18:1
18:0 / 130.068 / 775.5984 / 775.5970 / 1.8 / d18:1/18:0
18:0 / 132.084 / 777.6123 / 777.6127 / -0.5 / -
20:2 / 128.584 / 799.5971 / 799.5970 / 0.1 / -
20:1 / 132.132 / 801.6133 / 801.6127 / 0.7 / -
20:0 / 135.385 / 803.6290 / 803.6283 / 0.9 / d18:1/20:0
Lipid Class / Lipid species / Retention time / Molecular ion [M+HCOO-]-(m/z) / Error (ppm) / Structural information
(min) / measured mass / calculated mass
21:0 / 138.197 / 817.6434 / 817.6439 / -0.6 / -
22:3 / 129.971 / 825.6137 / 825.6127 / 1.2 / -
22:2 / 133.132 / 827.6273 / 827.6282 / -1.1 / -
22:1 / 136.648 / 829.6448 / 829.6440 / 1.0 / -
22:0 / 141.036 / 831.6597 / 831.6596 / 0.1 / d18:1/22:0
23:1 / 139.503 / 843.6595 / 843.6595 / 0.0 / -
23:0 / 143.487 / 845.6747 / 845.6752 / -0.6 / -
24:3 / 134.939 / 853.6430 / 853.6438 / -0.9 / -
24:2 / 138.326 / 855.6591 / 855.6595 / -0.5 / d18:1/24:2
24:1 / 141.939 / 857.6759 / 857.6752 / 0.8 / d18:1/24:1
24:0 / 145.213 / 859.6913 / 859.6909 / 0.5 / d18:1/24:0
25:1 / 144.084 / 871.6912 / 871.6908 / 0.5 / -
25:0 / 146.665 / 873.7066 / 873.7065 / 0.1 / -
26:3 / 140.487 / 881.6741 / 881.6751 / -1.1 / -
26:2 / 143.552 / 883.6901 / 883.6908 / -0.8 / d18:1/26:2
26:1 / 145.746 / 885.7057 / 885.7065 / -0.9 / d18:1/26:1
26:0 / 147.875 / 887.7222 / 887.7222 / 0.0 / -