0 B12R0.5 CCCCCCCCCCCCBr 3768 [1,0,0,0,0,0|2,0,1]=4 1 B12R0.5 CCCCCCCCCCCCI 3943 [1,0,0,0,0,0|2,0,1]=4 2 B12R0.248 CCCCCCCCOC(=O)CN 12487 [1,0,0,0,0,0|2,0,0]=3 3 B12R0.248 COC(=O)CCCCCCCCO 18968 [1,0,0,0,0,0|1,0,0]=2 4 B14R0.393 CCCCCCCCCCC(=O)OCC 26627 [0,1,0,0,0,0|0,0,0]=1 5 B14R1.40 CCCCCCCCCC1OCCO1 31816 [0,0,0,1,0,0|0,0,2]=3 6 B14R1.520 CCOC(=O)NCCN1CCNCC1 12268 [0,0,0,1,0,0|3,0,0]=4 7 B11R0.3 CCCCCCCCCCCBr 3840 [2,0,0,0,0,0|1,0,1]=4 8 B11R0.3 CCCCCCCCCCCO 35937 [2,0,0,0,0,0|1,0,1]=4 9 B11R0.148 CCCCCCCCCC(=O)[O-] 29720 [2,0,0,0,0,0|0,0,1]=3 10 B11R0.148 CCCCCCCCC[C@H](C)O 15557 [2,0,0,0,0,0|0,0,2]=4 11 B13R0.367 CCOC(=O)CCCCC(Cl)CCCl 36161 [1,1,0,0,0,0|1,0,0]=3 12 B13R0.336 CCCCCCCCCCCCCO 35600 [1,1,0,0,0,0|1,0,1]=4 13 B15R2.1356 CCOC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1 25662 [0,0,0,2,0,0|1,0,0]=3