0 B9R0.5 CCOC(=O)CCCC#N SY025760 [1,0,0,0,0,0|1,0,2]=4 1 B9R0.5 CCOC(=O)CCCCBr SY002795 [1,0,0,0,0,0|1,0,1]=3 2 B9R0.5 CCOC(=O)COCCCl SY105048 [1,0,0,0,0,0|2,0,1]=4 3 B9R0.5 CCOC(=O)COCCI SY272402 [1,0,0,0,0,0|2,0,1]=4 4 B9R0.18 C=CCOC(=O)NCCN SY260021 [1,0,0,0,0,0|2,0,0]=3 5 B9R0.45 C=CCCCCCCCBr SY105453 [1,0,0,0,0,0|2,0,1]=4 6 B9R0.45 CCCCCCCCC=O SY016777 [1,0,0,0,0,0|2,0,1]=4 7 B11R0.140 CCCCOC(=O)OCCCC SY164704 [0,1,0,0,0,0|1,0,2]=4 8 B8R0.1 C=CCOC(=O)CC#N SY032622 [2,0,0,0,0,0|1,0,1]=4 9 B8R0.1 CCOC(=O)CCCI SY014641 [2,0,0,0,0,0|1,0,1]=4 10 B8R0.1 CCOC(=O)CCCN SY015028 [2,0,0,0,0,0|1,0,1]=4 11 B8R0.1 CCOC(=O)CCCO SY263197 [2,0,0,0,0,0|1,0,1]=4 12 B8R0.1 CCOC(=O)CCNC SY019659 [2,0,0,0,0,0|1,0,1]=4 13 B8R0.4 C=CCCCCCCBr SY032409 [2,0,0,0,0,0|1,0,1]=4 14 B8R0.6 C#CCCCC(=O)OC SY275105 [2,0,0,0,0,0|0,0,2]=4 15 B8R0.6 CCC\C=C\C(=O)OC SY015809 [2,0,0,0,0,0|0,0,2]=4 16 B8R0.6 CCNCCC(=O)OC SY019881 [2,0,0,0,0,0|1,0,0]=3 17 B8R0.6 COC(=O)CCCC#N SY025759 [2,0,0,0,0,0|1,0,1]=4 18 B8R0.6 COC(=O)CCCC=O SY056793 [2,0,0,0,0,0|1,0,1]=4 19 B8R0.6 COC(=O)CCCCBr SY013898 [2,0,0,0,0,0|1,0,0]=3 20 B8R0.6 COC(=O)CCCCN SY117564 [2,0,0,0,0,0|1,0,0]=3 21 B8R0.6 COCCCC(=O)OC SY096667 [2,0,0,0,0,0|1,0,0]=3 22 B10R0.1 C=CCCCCC(=O)OCC SY284682 [1,1,0,0,0,0|0,0,2]=4 23 B10R0.1 CCOC(=O)CCCCCO SY116371 [1,1,0,0,0,0|0,0,1]=3 24 B10R0.1 CCOC(=O)COCCCCl SY238334 [1,1,0,0,0,0|1,0,1]=4 25 B10R0.2 CCCC(O)CC(=O)OCC SY048396 [1,1,0,0,0,0|0,0,1]=3 26 B10R0.3 CCOC(=O)CCCC(C)=O SY033235 [1,1,0,0,0,0|0,0,2]=4 27 B10R0.71 C=CCCCCCCCCBr SY036926 [1,1,0,0,0,0|1,0,1]=4 28 B10R0.71 CCCCC\C=C\C=C\C=O SY017792 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.10 CCCC1CCNC(=O)C1 SY263160 [1,0,0,1,0,0|1,0,1]=4 30 B10R1.11 CCOC(=O)C1CCNC1 SY007200 [1,0,0,1,0,0|1,0,1]=4 31 B10R1.11 CCOC(=O)[C@@H]1CCNC1 SY010181 [1,0,0,1,0,0|1,0,1]=4 32 B10R1.11 CCOC(=O)[C@@H]1CCNC1 SY011941 [1,0,0,1,0,0|1,0,1]=4 33 B10R1.11 CCOC(=O)[C@H]1CCNC1 SY010179 [1,0,0,1,0,0|1,0,1]=4 34 B10R1.11 N#CCC(=O)C1CCCC1 SY042272 [1,0,0,1,0,0|1,0,1]=4 35 B10R1.19 N#CC1CCCCCC1=O SY251081 [1,0,0,1,0,0|1,0,1]=4 36 B10R1.21 CCCCCC1=CC=CS1 SY034123 [1,0,0,1,0,0|0,1,1]=4 37 B10R1.25 CCN1CCC(=O)CC1=O SY028108 [1,0,0,1,0,0|2,0,0]=4 38 B10R1.78 O=C1CCCCCCCC1 SY129777 [1,0,0,1,0,0|0,0,2]=4 39 B10R1.130 CCCC1NC(=O)OC1=O SY225153 [1,0,0,1,0,0|2,0,0]=4 40 B10R1.130 CCC[C@@H]1NC(=O)OC1=O SY225261 [1,0,0,1,0,0|2,0,0]=4 41 B10R1.130 CCC[C@H]1NC(=O)OC1=O SY225262 [1,0,0,1,0,0|2,0,0]=4 42 B10R1.135 CCOC(=O)C1CC1CO SY121160 [1,0,0,1,0,0|1,0,1]=4 43 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1CO SY260281 [1,0,0,1,0,0|1,0,1]=4 44 B10R1.137 CCOC(=O)CC1CCC1 SY240747 [1,0,0,1,0,0|0,0,1]=3 45 B12R1.460 C=CCOC(=O)C1CCCC1=O SY224713 [0,1,0,1,0,0|0,0,1]=3 46 B12R1.2606 C=CC[C@@]1(C)C(=O)CCC[C@@H]1O SY288279 [0,1,0,1,0,0|2,0,0]=4