0  B7R0.10  COC(=O)C(N)CCl HY-W098273 [0,0,0,0,0,0|3,0,1]=4
1  B6R0.1  C[13CH2][13CH2][13C](=O)O[Na] HY-W750796 [1,0,0,0,0,0|2,0,1]=4
2  B6R0.3  C(C)=C(/C)C(=O)O HY-N6929 [1,0,0,0,0,0|2,0,1]=4
3  B6R0.3  CC(=O)C(=O)O[Na] HY-W015913 [1,0,0,0,0,0|2,0,0]=3
4  B6R0.3  CC(=O)C(=O)O[Na] HY-W015913R [1,0,0,0,0,0|2,0,0]=3
5  B6R0.3  CC(=O)[13C](=O)O[Na] HY-Y0781S3 [1,0,0,0,0,0|2,0,0]=3
6  B6R0.3  CCC(=O)C(C)=O HY-W012998R [1,0,0,0,0,0|0,0,0]=1
7  B6R0.3  CCC(Br)C(=O)O HY-W015333 [1,0,0,0,0,0|2,0,1]=4
8  B6R0.3  CC[C@@H](O)C(=O)O HY-113381A [1,0,0,0,0,0|1,0,2]=4
9  B6R0.3  C[13C](=O)C(=O)O[Na] HY-Y0781S [1,0,0,0,0,0|2,0,0]=3
10  B6R0.3  O=C(O)C(=O)CO HY-113013 [1,0,0,0,0,0|2,0,0]=3
11  B8R0.2  [13CH3][13CH]([13CH3])[13C](=O)[13C](=O)O[Na] HY-W006057AS16 [0,1,0,0,0,0|2,0,0]=3
12  B8R0.3  CCOC(=O)[C@@H](N)CO HY-W016996 [0,1,0,0,0,0|2,0,1]=4
13  B8R0.3  CCOC(=O)[C@@H](N)CS HY-Y1875 [0,1,0,0,0,0|2,0,1]=4
14  B8R1.11  CCN1CCCC1=O HY-B1620D [0,0,0,1,0,0|2,0,0]=3
15  B8R1.11  CCN1CCCC1=O HY-B1620K [0,0,0,1,0,0|2,0,0]=3
16  B5R0.1  C\C=C\C(C)=O HY-34748 [2,0,0,0,0,0|0,0,1]=3
17  B5R0.3  CCC(O)CC HY-W087988 [2,0,0,0,0,0|0,0,2]=4
18  B5R0.3  CC[PH](=O)CC HY-W094280 [2,0,0,0,0,0|1,0,0]=3
19  B5R0.5  O=C([O-])C(=O)[O-] HY-W140731 [2,0,0,0,0,0|2,0,0]=4
20  B5R0.5  O=[13C](O)[13C](=O)O HY-Y0262S1 [2,0,0,0,0,0|2,0,0]=4
21  B7R0.3  CCC(=O)OCOC HY-41616 [1,1,0,0,0,0|1,0,0]=3
22  B7R0.3  CCC(=O)\C=C\C=O HY-N12851 [1,1,0,0,0,0|0,0,2]=4
23  B7R0.5  CCOC(=O)C(C)N HY-W099247 [1,1,0,0,0,0|1,0,0]=3
24  B7R0.7  CCOC(=O)CNC HY-Y1144 [1,1,0,0,0,0|1,0,0]=3
25  B7R0.16  CC(C)C(=O)C(=O)O HY-W006057R [1,1,0,0,0,0|1,0,0]=3
26  B9R0.34  CCCC(=O)CC(=O)OC HY-W005176 [0,1,0,0,0,1|1,0,0]=3
27  B9R0.8  CSCCC(=O)C(=O)O[Na] HY-135046 [0,2,0,0,0,0|2,0,0]=4
28  B9R0.23  CC(C)CC(=O)[13C](=O)O[Na] HY-W012722BS1 [0,2,0,0,0,0|2,0,0]=4
29  B9R0.23  CC(C)C[13C](=O)[13C](=O)O[Na] HY-W017387S1 [0,2,0,0,0,0|2,0,0]=4
30  B9R0.23  [13CH3][13CH]([13CH3])[13CH2][13C](=O)[13C](=O)O[Na] HY-W017387S2 [0,2,0,0,0,0|2,0,0]=4
31  B9R0.37  CCOC(=O)C(CC)CC HY-W127442 [0,2,0,0,0,0|1,0,1]=4
32  B7R1.3  CC1=CCCCC1 HY-W004338 [1,0,0,1,0,0|1,0,0]=3
33  B7R1.4  CC1OCCC1=O HY-W010608 [1,0,0,1,0,0|1,0,1]=4
34  B9R1.69  NC1CCC(=O)NC1=O HY-34590 [0,0,0,1,0,1|1,0,0]=3
35  B9R1.69  O=C1NCC(F)C(=O)N1 HY-134160 [0,0,0,1,0,1|2,0,0]=4
36  B9R1.132  COC1=C(Br)C(=O)CC1 HY-42858 [0,1,0,1,0,0|1,0,1]=4