0 B11R0.6 CC(C)CCOC(=O)CC(C)C HR132069 [0,0,0,0,0,0|1,0,1]=2 1 B10R0.3 CCCC(=O)OCCC(C)C HR131806 [1,0,0,0,0,0|0,0,1]=2 2 B10R0.6 CC(=O)CC(=O)OCCC#N FIJL00502 [1,0,0,0,0,0|1,0,1]=3 3 B10R0.6 CCCCOC(=O)CC(C)C HR122128 [1,0,0,0,0,0|1,0,1]=3 4 B10R0.6 COCCOC(=O)CC(C)=O HR133436 [1,0,0,0,0,0|1,0,0]=2 5 B10R0.97 CC(C)CCCCCC(=O)O HR101874 [1,0,0,0,0,0|2,0,1]=4 6 B10R0.97 CC(C)CCCCCC(=O)O HR144807 [1,0,0,0,0,0|2,0,1]=4 7 B12R1.101 CC(C)CC1CC(=O)OC(=O)C1 HR121420 [0,0,0,1,0,0|2,0,0]=3 8 B10R0.96 CC(=O)CC(=O)CCC(=O)O HR144059 [0,0,0,0,1,0|2,0,1]=4 9 B10R0.96 CC(=O)CC(=O)OCC(C)C HR136696 [0,0,0,0,1,0|0,0,0]=1 10 B10R0.96 CC(C)COC(=O)CC(C)C HR123848 [0,0,0,0,1,0|1,0,1]=3 11 B10R0.98 CC(C)CCOC(=O)C(C)C HR137707 [0,0,0,0,1,0|1,0,1]=3 12 B10R0.98 CC(C)CCOC(=O)C(C)O HR104630 [0,0,0,0,1,0|0,0,2]=3 13 B9R0.1 C=CC(=O)OCCN(C)C HR125499 [2,0,0,0,0,0|1,0,1]=4 14 B9R0.2 CCCCCCCC(C)=O HR133915 [2,0,0,0,0,0|1,0,1]=4 15 B9R0.2 CCCCC\C=C\C(C)=O HR136203 [2,0,0,0,0,0|1,0,1]=4 16 B9R0.5 CCCCOC(=O)CC#N HR124420 [2,0,0,0,0,0|1,0,1]=4 17 B9R0.5 CCCCOC(=O)CCS HR144609 [2,0,0,0,0,0|0,1,1]=4 18 B9R0.4 C=CCOC(=O)CC(C)=O HR126314 [2,0,0,0,0,0|0,0,2]=4 19 B9R0.4 CCCOC(=O)CC(C)C HR123585 [2,0,0,0,0,0|1,0,1]=4 20 B11R0.1 C\C=C\C(=O)OC(C)CC(C)C HR108384 [1,1,0,0,0,0|0,0,1]=3 21 B11R0.145 CCC(C)C(=O)OCCC(C)C HR123321 [1,1,0,0,0,0|0,0,1]=3 22 B11R0.147 CCCCC(=O)OCCC(C)C HR110855 [1,1,0,0,0,0|0,0,1]=3 23 B11R0.107 CCC(C)COC(=O)CC(C)C HR144506 [1,1,0,0,0,0|1,0,1]=4 24 B11R0.318 C=C(C)C(=O)OCC[N+](C)(C)C HR130769 [0,1,0,0,1,0|2,0,0]=4 25 B11R0.318 C=C(C)C(=O)OCC[N+](C)(C)C HR145340 [0,1,0,0,1,0|2,0,0]=4 26 B11R1.424 CC1=CCCC(C)(C)C1C=O HR124398 [1,0,0,1,0,0|2,0,0]=4 27 B11R1.34 CCCC1CC(=O)CC(=O)C1 HR119391 [1,0,0,1,0,0|1,0,0]=3 28 B11R1.143 CC(=O)N1CCCCCC1=O HR104987 [1,0,0,1,0,0|2,0,0]=4 29 B13R1.1814 CCC(=O)N1C(=O)OCC1C(C)C HR2451 [0,1,0,1,0,0|1,0,0]=3 30 B13R2.5187 CC1CCC2C(=O)OC(=O)C2C1 HR109660 [0,0,0,2,0,0|2,0,0]=4 31 B13R2.5187 CC1CCC2C(=O)OC(=O)C2C1 HR130223 [0,0,0,2,0,0|2,0,0]=4 32 B13R2.5187 CC1CCC2C(=O)OC(=O)C2C1 HR140830 [0,0,0,2,0,0|2,0,0]=4 33 B9R0.48 CC(C)COC(=O)CC#N HR125981 [1,0,0,0,1,0|1,0,1]=4 34 B9R0.48 CCCC(=O)OCC(C)C HR119768 [1,0,0,0,1,0|0,0,1]=3 35 B9R0.48 C\C=C\C(=O)OCC(C)C HR133085 [1,0,0,0,1,0|0,0,1]=3 36 B9R0.47 C=C(C)C(=O)OCCOC HR129605 [1,0,0,0,1,0|2,0,0]=4 37 B9R0.47 CCCCOC(=O)C(C)=O HR124899 [1,0,0,0,1,0|0,0,0]=2 38 B9R0.47 CCCCOC(=O)C(C)C HR144880 [1,0,0,0,1,0|1,0,1]=4 39 B9R0.47 CCCCOC(=O)C(C)O HR123058 [1,0,0,0,1,0|0,0,2]=4 40 B9R0.55 CC(C)CCCCC(=O)O HR141572 [1,0,0,0,1,0|1,0,1]=4 41 B9R0.55 CC(C)CCCCC(=O)[O-] HR103452 [1,0,0,0,1,0|1,0,1]=4 42 B9R0.55 CC(C)CCCCC(=O)[O-] HR143901 [1,0,0,0,1,0|1,0,1]=4 43 B9R0.7 C=C(C)C(=O)OCC(C)O HR136407 [0,0,0,0,2,0|2,0,0]=4 44 B9R0.7 CC(C)COC(=O)C(C)O HR129672 [0,0,0,0,2,0|0,0,2]=4 45 B9R0.53 CC(=O)CC(=O)CC(C)C HR120010 [0,0,0,0,2,0|0,0,0]=2 46 B9R0.53 CC(=O)CC(=O)OC(C)C HR133707 [0,0,0,0,2,0|0,0,0]=2 47 B9R0.53 C\C(N)=C/C(=O)OC(C)C HR138074 [0,0,0,0,2,0|1,0,1]=4 48 B11R0.46 CCCCOC(=O)CCC(C)=O HR130764 [1,0,0,0,0,1|0,0,0]=2 49 B11R0.46 CCCCOC(=O)\C=C\C(=O)[O-] HR140714 [1,0,0,0,0,1|1,0,1]=4 50 B11R0.46 COCCOC(=O)COC(C)=O HR142024 [1,0,0,0,0,1|1,0,0]=3