0 B9R0.2 CC(=O)OCCCCCCl 3676 [0,0,0,0,0,0|1,0,2]=3 1 B9R0.2 CCCCCCCC(=O)[O-] 12870 [0,0,0,0,0,0|2,0,2]=4 2 B9R0.2 C\C=C\C=C\COC(C)=O 13748 [0,0,0,0,0,0|0,0,2]=2 3 B8R0.7 CC(=O)OCCCCCl 13100 [1,0,0,0,0,0|1,0,1]=3 4 B8R0.7 CCCCCCC(C)=O 26418 [1,0,0,0,0,0|0,0,2]=3 5 B10R0.3 CCOC(=O)CCCC(C)=O 27277 [0,1,0,0,0,0|2,0,1]=4 6 B10R1.18 CC(=O)OC1CCNCC1 35466 [0,0,0,1,0,0|1,0,2]=4 7 B10R1.66 CC(=O)OCC1=CC=CO1 9970 [0,0,0,1,0,0|1,0,2]=4 8 B7R0.4 CC(=O)CCCCCl 29051 [2,0,0,0,0,0|1,0,1]=4 9 B7R0.4 CC(=O)O\C=C\CBr 28187 [2,0,0,0,0,0|1,0,0]=3 10 B7R0.4 CCCCCC(=O)Cl 21359 [2,0,0,0,0,0|1,0,1]=4 11 B7R0.4 CCC\C=C\C(C)=O 18920 [2,0,0,0,0,0|0,0,0]=2 12 B7R0.4 CCO\C=C\C(=O)O 20958 [2,0,0,0,0,0|2,0,0]=4 13 B7R0.4 COCCOC(=O)Cl 12774 [2,0,0,0,0,0|2,0,0]=4 14 B9R0.48 CCOC(=O)CCC(C)=O 11220 [1,1,0,0,0,0|1,0,1]=4 15 B9R0.48 CCOC(=O)\C=C\C(C)=O 18129 [1,1,0,0,0,0|1,0,1]=4 16 B11R0.46 CCCCOC(=O)CCC(C)=O 11224 [0,2,0,0,0,0|1,0,1]=4 17 B9R1.15 CCC1CCCOC1=O 26311 [1,0,0,1,0,0|0,0,2]=4 18 B9R1.6 CC(=O)N1CCCCC1 7729 [1,0,0,1,0,0|1,0,1]=4 19 B9R1.6 O=C(O)C1CC=CCC1 11032 [1,0,0,1,0,0|2,0,0]=4 20 B9R1.6 O=C(O)[C@@H]1CC=CCC1 24718 [1,0,0,1,0,0|2,0,0]=4 21 B9R1.13 O=C(Cl)OC1CCCC1 25250 [1,0,0,1,0,0|1,0,1]=4 22 B9R1.13 O=C(O)CC1C=CCC1 31950 [1,0,0,1,0,0|2,0,0]=4 23 B11R1.20 CC(=O)OC1CCC(O)CC1 24998 [0,1,0,1,0,0|0,0,2]=4