vgo_36_formula

id
C
H
O
N
S
DBE
molecular_weight
mass fraction_wtpct
compound type
1 14 30 0 0 0 0 198.24 0.153335 Saturates
2 15 32 0 0 0 0 212.256 0.403082 Saturates
3 16 34 0 0 0 0 226.272 0.791218 Saturates
4 17 36 0 0 0 0 240.288 1.25169 Saturates
5 18 38 0 0 0 0 254.304 1.69243 Saturates
6 19 40 0 0 0 0 268.32 2.54729 Saturates
7 20 42 0 0 0 0 282.336 3.55715 Saturates
8 21 44 0 0 0 0 296.352 4.50898 Saturates
9 22 46 0 0 0 0 310.368 5.73543 Saturates
10 23 48 0 0 0 0 324.384 7.01341 Saturates
11 24 50 0 0 0 0 338.4 6.30491 Saturates
12 25 52 0 0 0 0 352.416 5.71558 Saturates
13 26 54 0 0 0 0 366.432 4.36812 Saturates
14 27 56 0 0 0 0 380.448 3.89437 Saturates
15 28 58 0 0 0 0 394.464 2.88005 Saturates
16 29 60 0 0 0 0 408.48 2.19851 Saturates
17 30 62 0 0 0 0 422.496 1.29001 Saturates
18 31 64 0 0 0 0 436.512 0.823507 Saturates
19 32 66 0 0 0 0 450.528 0.483699 Saturates
20 33 68 0 0 0 0 464.544 0.304121 Saturates
21 34 70 0 0 0 0 478.56 0.13876 Saturates
22 12 24 0 0 0 1 168.192 0.045633 Saturates
23 14 28 0 0 0 1 196.224 0.142778 Saturates
24 15 30 0 0 0 1 210.24 0.255465 Saturates
25 16 32 0 0 0 1 224.256 0.395769 Saturates
26 17 34 0 0 0 1 238.272 0.496024 Saturates
27 18 36 0 0 0 1 252.288 0.604161 Saturates
28 19 38 0 0 0 1 266.304 0.667139 Saturates
29 20 40 0 0 0 1 280.32 0.728839 Saturates
30 21 42 0 0 0 1 294.336 0.776472 Saturates
31 22 44 0 0 0 1 308.352 0.789847 Saturates
32 23 46 0 0 0 1 322.368 0.859773 Saturates
33 24 48 0 0 0 1 336.384 0.882807 Saturates
34 25 50 0 0 0 1 350.4 0.892782 Saturates
35 26 52 0 0 0 1 364.416 0.877605 Saturates
36 27 54 0 0 0 1 378.432 0.800602 Saturates
37 28 56 0 0 0 1 392.448 0.729541 Saturates
38 29 58 0 0 0 1 406.464 0.67288 Saturates
39 30 60 0 0 0 1 420.48 0.585668 Saturates
40 31 62 0 0 0 1 434.496 0.494552 Saturates
41 32 64 0 0 0 1 448.512 0.348142 Saturates
42 33 66 0 0 0 1 462.528 0.263421 Saturates
43 34 68 0 0 0 1 476.544 0.191968 Saturates
44 35 70 0 0 0 1 490.56 0.14307 Saturates
45 36 72 0 0 0 1 504.576 0.089639 Saturates
46 13 24 0 0 0 2 180.192 0.047368 Saturates
47 14 26 0 0 0 2 194.208 0.145525 Saturates
48 15 28 0 0 0 2 208.224 0.371417 Saturates
49 16 30 0 0 0 2 222.24 0.53257 Saturates
50 17 32 0 0 0 2 236.256 0.579708 Saturates
51 18 34 0 0 0 2 250.272 0.725861 Saturates
52 19 36 0 0 0 2 264.288 0.726677 Saturates
53 20 38 0 0 0 2 278.304 0.792501 Saturates
54 21 40 0 0 0 2 292.32 0.818969 Saturates
55 22 42 0 0 0 2 306.336 0.713297 Saturates
56 23 44 0 0 0 2 320.352 0.74913 Saturates
57 24 46 0 0 0 2 334.368 0.805407 Saturates
58 25 48 0 0 0 2 348.384 0.779836 Saturates
59 26 50 0 0 0 2 362.4 0.810432 Saturates
60 27 52 0 0 0 2 376.416 0.835214 Saturates
61 28 54 0 0 0 2 390.432 0.874838 Saturates
62 29 56 0 0 0 2 404.448 0.866799 Saturates
63 30 58 0 0 0 2 418.464 0.860102 Saturates
64 31 60 0 0 0 2 432.48 0.79838 Saturates
65 32 62 0 0 0 2 446.496 0.632404 Saturates
66 33 64 0 0 0 2 460.512 0.545706 Saturates
67 34 66 0 0 0 2 474.528 0.43787 Saturates
68 35 68 0 0 0 2 488.544 0.354022 Saturates
69 36 70 0 0 0 2 502.56 0.251611 Saturates
70 14 24 0 0 0 3 192.192 0.043509 Saturates
71 15 26 0 0 0 3 206.208 0.099334 Saturates
72 16 28 0 0 0 3 220.224 0.149472 Saturates
73 17 30 0 0 0 3 234.24 0.170193 Saturates
74 18 32 0 0 0 3 248.256 0.239534 Saturates
75 19 34 0 0 0 3 262.272 0.279352 Saturates
76 20 36 0 0 0 3 276.288 0.289416 Saturates
77 21 38 0 0 0 3 290.304 0.277657 Saturates
78 22 40 0 0 0 3 304.32 0.283144 Saturates
79 23 42 0 0 0 3 318.336 0.394465 Saturates
80 24 44 0 0 0 3 332.352 0.388021 Saturates
81 25 46 0 0 0 3 346.368 0.394322 Saturates
82 26 48 0 0 0 3 360.384 0.436498 Saturates
83 27 50 0 0 0 3 374.4 0.514501 Saturates
84 28 52 0 0 0 3 388.416 0.501852 Saturates
85 29 54 0 0 0 3 402.432 0.738177 Saturates
86 30 56 0 0 0 3 416.448 0.756584 Saturates
87 31 58 0 0 0 3 430.464 0.542496 Saturates
88 32 60 0 0 0 3 444.48 0.397096 Saturates
89 33 62 0 0 0 3 458.496 0.349584 Saturates
90 34 64 0 0 0 3 472.512 0.245565 Saturates
91 35 66 0 0 0 3 486.528 0.253221 Saturates
92 36 68 0 0 0 3 500.544 0.156398 Saturates
93 16 26 0 0 0 4 218.208 0.021296 Saturates
94 17 28 0 0 0 4 232.224 0.03827 Saturates
95 18 30 0 0 0 4 246.24 0.043651 Saturates
96 19 32 0 0 0 4 260.256 0.052442 Saturates
97 20 34 0 0 0 4 274.272 0.059651 Saturates
98 21 36 0 0 0 4 288.288 0.071393 Saturates
99 22 38 0 0 0 4 302.304 0.098217 Saturates
100 23 40 0 0 0 4 316.32 0.104024 Saturates
101 24 42 0 0 0 4 330.336 0.124945 Saturates
102 25 44 0 0 0 4 344.352 0.118556 Saturates
103 26 46 0 0 0 4 358.368 0.128737 Saturates
104 27 48 0 0 0 4 372.384 0.30681 Saturates
105 28 50 0 0 0 4 386.4 0.199658 Saturates
106 29 52 0 0 0 4 400.416 0.502494 Saturates
107 30 54 0 0 0 4 414.432 0.479119 Saturates
108 31 56 0 0 0 4 428.448 0.270407 Saturates
109 32 58 0 0 0 4 442.464 0.164419 Saturates
110 33 60 0 0 0 4 456.48 0.13551 Saturates
111 34 62 0 0 0 4 470.496 0.084717 Saturates
112 36 66 0 0 0 4 498.528 0.053445 Saturates
113 20 32 0 0 0 5 272.256 0.007229 Saturates
114 21 34 0 0 0 5 286.272 0.00616 Saturates
115 22 36 0 0 0 5 300.288 0.009419 Saturates
116 23 38 0 0 0 5 314.304 0.011213 Saturates
117 24 40 0 0 0 5 328.32 0.014198 Saturates
118 25 42 0 0 0 5 342.336 0.01889 Saturates
119 26 44 0 0 0 5 356.352 0.030289 Saturates
120 27 46 0 0 0 5 370.368 0.04324 Saturates
121 28 48 0 0 0 5 384.384 0.056048 Saturates
122 29 50 0 0 0 5 398.4 0.072508 Saturates
123 30 52 0 0 0 5 412.416 0.06107 Saturates
124 31 54 0 0 0 5 426.432 0.046559 Saturates
125 32 56 0 0 0 5 440.448 0.033651 Saturates
126 33 58 0 0 0 5 454.464 0.028104 Saturates
127 34 60 0 0 0 5 468.48 0.017709 Saturates
128 35 62 0 0 0 5 482.496 0.017126 Saturates
129 26 42 0 0 0 6 354.336 0.008235 Saturates
130 27 44 0 0 0 6 368.352 0.014415 Saturates
131 28 46 0 0 0 6 382.368 0.014666 Saturates
132 29 48 0 0 0 6 396.384 0.019533 Saturates
133 30 50 0 0 0 6 410.4 0.022064 Saturates
134 31 52 0 0 0 6 424.416 0.017079 Saturates
135 32 54 0 0 0 6 438.432 0.014573 Saturates
136 34 58 0 0 0 6 466.464 0.012 Saturates
137 16 26 0 0 0 4 218.208 0.018719 Aromatics
138 17 28 0 0 0 4 232.224 0.03364 Aromatics
139 18 30 0 0 0 4 246.24 0.03837 Aromatics
140 19 32 0 0 0 4 260.256 0.046098 Aromatics
141 20 34 0 0 0 4 274.272 0.052434 Aromatics
142 21 36 0 0 0 4 288.288 0.062755 Aromatics
143 22 38 0 0 0 4 302.304 0.086334 Aromatics
144 23 40 0 0 0 4 316.32 0.091439 Aromatics
145 24 42 0 0 0 4 330.336 0.109828 Aromatics
146 25 44 0 0 0 4 344.352 0.104213 Aromatics
147 26 46 0 0 0 4 358.368 0.113162 Aromatics
148 27 48 0 0 0 4 372.384 0.26969 Aromatics
149 28 50 0 0 0 4 386.4 0.175502 Aromatics
150 29 52 0 0 0 4 400.416 0.441698 Aromatics
151 30 54 0 0 0 4 414.432 0.421151 Aromatics
152 31 56 0 0 0 4 428.448 0.237691 Aromatics
153 32 58 0 0 0 4 442.464 0.144526 Aromatics
154 33 60 0 0 0 4 456.48 0.119115 Aromatics
155 34 62 0 0 0 4 470.496 0.074467 Aromatics
156 36 66 0 0 0 4 498.528 0.046978 Aromatics
157 20 32 0 0 0 5 272.256 0.020886 Aromatics
158 21 34 0 0 0 5 286.272 0.017797 Aromatics
159 22 36 0 0 0 5 300.288 0.027212 Aromatics
160 23 38 0 0 0 5 314.304 0.032395 Aromatics
161 24 40 0 0 0 5 328.32 0.041021 Aromatics
162 25 42 0 0 0 5 342.336 0.054577 Aromatics
163 26 44 0 0 0 5 356.352 0.087511 Aromatics
164 27 46 0 0 0 5 370.368 0.124928 Aromatics
165 28 48 0 0 0 5 384.384 0.161932 Aromatics
166 29 50 0 0 0 5 398.4 0.209487 Aromatics
167 30 52 0 0 0 5 412.416 0.17644 Aromatics
168 31 54 0 0 0 5 426.432 0.134517 Aromatics
169 32 56 0 0 0 5 440.448 0.097224 Aromatics
170 33 58 0 0 0 5 454.464 0.081197 Aromatics
171 34 60 0 0 0 5 468.48 0.051164 Aromatics
172 35 62 0 0 0 5 482.496 0.04948 Aromatics
173 26 42 0 0 0 6 354.336 0.023466 Aromatics
174 27 44 0 0 0 6 368.352 0.041078 Aromatics
175 28 46 0 0 0 6 382.368 0.041793 Aromatics
176 29 48 0 0 0 6 396.384 0.055664 Aromatics
177 30 50 0 0 0 6 410.4 0.062875 Aromatics
178 31 52 0 0 0 6 424.416 0.048669 Aromatics
179 32 54 0 0 0 6 438.432 0.041529 Aromatics
180 34 58 0 0 0 6 466.464 0.034196 Aromatics
181 26 40 0 0 0 7 352.32 0.025422 Aromatics
182 27 42 0 0 0 7 366.336 0.024953 Aromatics
183 28 44 0 0 0 7 380.352 0.019867 Aromatics
184 29 46 0 0 0 7 394.368 0.032533 Aromatics
185 30 48 0 0 0 7 408.384 0.033216 Aromatics
186 31 50 0 0 0 7 422.4 0.038698 Aromatics
187 31 48 0 0 0 8 420.384 0.020463 Aromatics
188 21 27 0 1 1 9 325.286 0.0 Neutral nitrogen compounds
189 17 36 0 0 1 0 272.348 0.0 Sulfidic compounds
190 13 10 0 0 1 9 198.14 0.0 Thiophenic compounds
191 12 24 2 0 0 1 200.192 0.0 Acidic fraction