LECO® ChromaTOF® optimized for Pegasus® 4D

Peak Table (1)

Peak # Name Quant S/N R.T. (s) Area % Sample Similarity Quant Masses Group Area
10 Toluene 138684 288.9 17.257 RUN 1_1D:1 959 91 88076189
97 Cyclopropylphenylmethane 87067 1892.2 8.6496 RUN 1_1D:1 755 91 44145433
32 Ethylbenzene 81408 434.5 7.1767 RUN 1_1D:1 965 91 36628510
52 à-Methylstyrene 56833 658.4 4.2783 RUN 1_1D:1 921 118 21835650
17 1-Heptene, 2-methyl- 38025 314 3.4694 RUN 1_1D:1 936 56 17707038
79 1-Octanol, 2-butyl- 32462 1230.1 3.4372 RUN 1_1D:1 877 71 17542636
41 Nonane 22585 505.3 2.6871 RUN 1_1D:1 913 57 13714232
8 Heptane, 4-methyl- 27159 287.2 2.4044 RUN 1_1D:1 806 71 12271718
55 1-Decene 26680 676.9 2.3591 RUN 1_1D:1 921 70 12040185
66 3-Dodecene, (Z)- 24812 865 1.9169 RUN 1_1D:1 905 56 9783194
64 1-Octene, 3,7-dimethyl- 23126 836.4 1.8709 RUN 1_1D:1 842 70 9548640
30 2,4-Dimethyl-1-heptene 17278 401.1 1.8644 RUN 1_1D:1 945 126 9515657
19 1-Octene 19043 321.2 1.8229 RUN 1_1D:1 903 56 9303750
56 Decane 17922 693.5 1.5834 RUN 1_1D:1 930 57 8081229
81 n-Tridecan-1-ol 20272 1257.6 1.5023 RUN 1_1D:1 839 85 7667654
27 1,5-Heptadien-4-one, 3,3,6-trimethyl- 11050 384.9 1.3548 RUN 1_1D:1 861 83 6914694
68 Benzene, (3-methyl-3-butenyl)- 13304 950.3 1.3244 RUN 1_1D:1 925 91 6759624
6 Cyclopentanone, 2,4-dimethyl- 6832.2 274.6 1.3138 RUN 1_1D:1 838 69 6705436
65 1-Octene, 3,7-dimethyl- 17481 844.2 1.3088 RUN 1_1D:1 828 70 6679601
82 Benzene, (3-methylpentyl)- 15035 1261.6 1.2171 RUN 1_1D:1 728 92 6212005
67 Undecane 10303 880.7 1.1520 RUN 1_1D:1 937 57 5879671
37 1-Nonene 16921 492.1 1.1334 RUN 1_1D:1 851 56 5784522
7 Heptane, 3-ethyl-5-methylene- 10156 274.9 1.0446 RUN 1_1D:1 834 70 5331193
28 Cyclohexane, 1,3,5-trimethyl- 11289 387.5 0.99527 RUN 1_1D:1 900 111 5079664
83 Benzene, (3-methyl-1-methylenepentyl)- 11972 1341 0.95427 RUN 1_1D:1 830 118 4870393
75 Dodecane 7430.2 1059.7 0.94144 RUN 1_1D:1 936 57 4804921
38 Cyclopentane, 1,2,3,4,5-pentamethyl- 16312 492.5 0.92894 RUN 1_1D:1 751 84 4741112
22 Octane 11114 334.4 0.89098 RUN 1_1D:1 938 85 4547377
3 2,4-Dimethyl-1-hexene 8545.8 267.6 0.82595 RUN 1_1D:1 884 56 4215495
23 1-Hexene, 3,3,5-trimethyl- 6284.9 352.5 0.78116 RUN 1_1D:1 839 83 3986879
45 Pyruvic acid, 3-hexenyl ester 8277.4 526.2 0.75145 RUN 1_1D:1 822 82 3835221
100 Benzene, (2-nitropropyl)- 6484.9 2581.2 0.72344 RUN 1_1D:1 687 91 3692276
95 Benzene, 1,1'-(1,3-propanediyl)bis- 7596.7 1798.4 0.71875 RUN 1_1D:1 928 92 3668369
33 Cyclohexene, 3,3,5-trimethyl- 7711.3 453 0.69588 RUN 1_1D:1 834 109 3551611
61 Benzene, n-butyl- 6393.4 798.2 0.66224 RUN 1_1D:1 857 91 3379914
57 Octane, 3,3-dimethyl- 7214.1 706.5 0.65411 RUN 1_1D:1 852 71 3338442
5 Cyclopentene, 3-ethyl- 5282.4 273.6 0.65019 RUN 1_1D:1 878 67 3318414
74 Cyclopropane, 1-ethyl-2-heptyl- 7860.3 1045 0.64625 RUN 1_1D:1 910 56 3298299
58 Octane, 3,3-dimethyl- 6554.7 714.4 0.63673 RUN 1_1D:1 833 71 3249723
35 Cyclohexene, 3,3,5-trimethyl- 6894.2 467.6 0.62720 RUN 1_1D:1 878 109 3201069
47 Benzene, (1-methylethyl)- 7571.0 547.7 0.57849 RUN 1_1D:1 901 105 2952493
80 n-Tridecan-1-ol 3131.6 1243.6 0.55571 RUN 1_1D:1 825 69 2836208
20 Cyclopentene, 1,2,3-trimethyl- 6396.4 326.9 0.53880 RUN 1_1D:1 915 95 2749939
70 1,4-Heptadiene, 3,3,6-trimethyl- 3056.2 965 0.52321 RUN 1_1D:1 802 69 2670347
87 Tetradecane 3398.9 1393.9 0.50391 RUN 1_1D:1 925 57 2571840
31 Cyclohexane, 1,3,5-trimethyl-, (1à,3à,5á)- 6619.9 428.5 0.46135 RUN 1_1D:1 911 111 2354656
91 Bibenzyl 3613.1 1597.9 0.44494 RUN 1_1D:1 895 91 2270868
69 Benzene, (1-methylenebutyl)- 5724.0 955.5 0.43698 RUN 1_1D:1 895 118 2230253
89 Hexadecane 2861.3 1563.5 0.41991 RUN 1_1D:1 901 57 2143149
42 Bicyclo[3.1.1]heptan-2-one, 6,6-dimethyl-, (1R)- 3134.5 505.7 0.39140 RUN 1_1D:1 781 83 1997602
84 1,5-Octadiene, 7-methyl-3-(1-methylethyl)- 1941.0 1341.6 0.38529 RUN 1_1D:1 747 55 1966411
48 Benzene, 2-propenyl- 4728.9 589.1 0.36927 RUN 1_1D:1 905 117 1884668
78 7-Tetradecene, (Z)- 3893.6 1215.4 0.36187 RUN 1_1D:1 921 70 1846884
25 Hexane, 2,3,4-trimethyl- 4001.9 367.5 0.33769 RUN 1_1D:1 899 85 1723506
94 Heptadecane 2162.3 1719.2 0.33224 RUN 1_1D:1 916 57 1695681
50 Benzene, propyl- 3303.8 603.8 0.33224 RUN 1_1D:1 930 91 1695664
86 1-Tridecene 2877.1 1379.7 0.30191 RUN 1_1D:1 931 56 1540871
59 Benzene, 2-propenyl- 3775.4 743.5 0.29683 RUN 1_1D:1 910 117 1514946
34 3-Octyne, 6-methyl- 1997.1 453.3 0.28876 RUN 1_1D:1 704 57 1473773
60 Hexane, 1-chloro- 2853.5 773.3 0.28812 RUN 1_1D:1 697 91 1470512
98 Hexadecane 1461.5 1996.8 0.26917 RUN 1_1D:1 882 57 1373784
18 Cyclopentane 2869.1 317.4 0.26524 RUN 1_1D:1 907 70 1353740
96 Eicosane 1559.0 1863.1 0.25827 RUN 1_1D:1 896 57 1318165
49 2-Pentyn-4-one 1970.6 591.2 0.24279 RUN 1_1D:1 783 67 1239134
26 1-Methyl-2-methylenecyclohexane 2034.4 375.7 0.24123 RUN 1_1D:1 890 68 1231206
44 3-Methylbut-2-enoic acid, 3-fluorophenyl ester 1303.5 524.7 0.23843 RUN 1_1D:1 756 83 1216895
39 Styrene 1308.9 492.6 0.22401 RUN 1_1D:1 974 86 1143290
51 Nonane, 4-methyl- 1755.2 619.1 0.21649 RUN 1_1D:1 904 57 1104918

Page 1 of 2
LECO® ChromaTOF® optimized for Pegasus® 4D
Peak Table (1)

Peak # Name Quant S/N R.T. (s) Area % Sample Similarity Quant Masses Group Area
85 Benzene, 3-heptenyl- 1874.3 1374.9 0.21332 RUN 1_1D:1 749 91 1088751
1 1,4-Hexadiene, 4-methyl- 1663.0 255.1 0.21088 RUN 1_1D:1 880 81 1076311
13 1,3-Pentadiene, 2,3-dimethyl- 1952.0 298.4 0.20605 RUN 1_1D:1 783 79 1051655
62 2-Hexene, 4,4,5-trimethyl- 1819.0 798.7 0.19195 RUN 1_1D:1 706 83 979690
12 1,5-Hexadiene, 2,5-dimethyl- 1519.2 296.1 0.18464 RUN 1_1D:1 776 95 942384
53 1,9-Decadiene 2833.2 659.8 0.18215 RUN 1_1D:1 904 54 929631
16 Bicyclo[4.1.0]hept-2-ene 1535.1 307.9 0.18199 RUN 1_1D:1 904 79 928847
88 1-Tridecene 1741.3 1550.7 0.17877 RUN 1_1D:1 927 97 912407
90 n-Tridecan-1-ol 1495.9 1588.7 0.17405 RUN 1_1D:1 814 71 888315
36 1,8-Nonadiene 1317.4 473.3 0.15898 RUN 1_1D:1 877 54 811408
4 2,3-Dimethyl-1,4-pentadiene 1718.3 269.2 0.15628 RUN 1_1D:1 868 81 797621
21 3,3,5,5-Tetramethylcyclopentene 1846.9 329.2 0.15259 RUN 1_1D:1 843 109 778800
63 Benzene, (1-methylenepropyl)- 1853.0 799.1 0.14673 RUN 1_1D:1 797 117 748874
92 Benzene, 1,1'-(1-methyl-1,2-ethanediyl)bis- 1519.7 1644.7 0.14481 RUN 1_1D:1 957 105 739098
29 Cyclohexane, ethyl- 1265.0 391.2 0.14241 RUN 1_1D:1 892 83 726846
93 Cetene 1298.8 1707.8 0.13944 RUN 1_1D:1 923 97 711663
46 2-Furoic acid, 2,3,4,6-tetrachlorophenyl ester 1479.0 534.4 0.13906 RUN 1_1D:1 835 95 709732
15 3-Hepten-2-one 1573.7 307.1 0.13360 RUN 1_1D:1 815 97 681875
99 Benzene, 1,1'-(3-methyl-1-propene-1,3-diyl)bis- 1354.1 1999.4 0.13350 RUN 1_1D:1 838 115 681331
9 1,3-Pentadiene, 2,3-dimethyl- 1479.6 288.1 0.13278 RUN 1_1D:1 670 81 677665
2 Heptane, 3-methylene- 1474.8 256.3 0.13043 RUN 1_1D:1 698 70 665693
73 Naphthalene 1439.8 1036.2 0.12962 RUN 1_1D:1 872 128 661568
76 à-Methylstyrene 1591.1 1124 0.12330 RUN 1_1D:1 844 118 629286
14 cis-4-Hydroxycyclohexanecarboxylic acid lactone 1287.1 300.5 0.11696 RUN 1_1D:1 768 70 596944
54 1,3-Methanopentalene, 1,2,3,5-tetrahydro- 1810.6 676.3 0.11378 RUN 1_1D:1 692 117 580721
77 2-Undecene, 8-methyl-, (Z)- 1293.1 1202.2 0.11277 RUN 1_1D:1 806 84 575556
43 4-Nonene 1253.2 515 0.11252 RUN 1_1D:1 867 56 574260
11 3,4-Heptadiene 1402.0 293 0.11023 RUN 1_1D:1 894 96 562598
40 1,3,5,7-Cyclooctatetraene 1976.2 495.6 0.11014 RUN 1_1D:1 786 91 562112
24 Cyclotrisiloxane, hexamethyl- 1579.4 358.2 0.10985 RUN 1_1D:1 909 207 560634
71 Benzene, pentyl- 1312.5 983.2 0.10568 RUN 1_1D:1 921 92 539375
72 Benzene, (3-methyl-1-methylenebutyl)- 1306.9 1034.2 0.10338 RUN 1_1D:1 849 118 527644

Page 2 of 2