0  B10R1.113  CC1=CC([N+](=O)[O-])=CN=C1 HY-W015796 [0,0,0,0,0,0|3,0,1]=4
1  B9R1.6  O=C(O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-N0216S1 [1,0,0,0,0,0|0,0,0]=1
2  B9R1.6  O=[13C](O)C1=CC=CC=C1 HY-N0216S2 [1,0,0,0,0,0|0,0,0]=1
3  B9R1.6  O=[13C](O)[13C]1=[13CH][13CH]=[13CH]N=[13CH]1 HY-B0143S3 [1,0,0,0,0,0|1,0,0]=2
4  B11R1.21  CC(C)C1=CC=C(O)C(O)=C1 HY-139430 [0,1,0,0,0,0|2,0,1]=4
5  B11R1.23  CNC(=O)C1=NC=CC(Br)=C1 HY-W107225 [0,1,0,0,0,0|3,0,0]=4
6  B11R1.74  O=C1C=C(C(=O)O)[15NH]C(=O)[15NH]1 HY-W016812S [0,1,0,0,0,0|2,0,1]=4
7  B11R1.74  O=C1C=C(C(=O)O)[15NH][13C](=O)[15NH]1 HY-N0157S1 [0,1,0,0,0,0|2,0,1]=4
8  B11R1.167  CN1C=CC(=O)C(C(N)=O)=C1 HY-113472 [0,1,0,0,0,0|3,0,0]=4
9  B11R1.167  NC1=CC(C(=O)O)=C(O)C=C1 HY-15027 [0,1,0,0,0,0|1,0,0]=2
10  B11R1.167  N[13C]1=[13CH][13C](C(=O)O)=[13C](O)[13CH]=[13CH]1 HY-143704S [0,1,0,0,0,0|1,0,0]=2
11  B11R1.266  NN[13C]1=[13CH][13CH]=[13CH][13C]([N+](=O)[O-])=[13CH]1 HY-133689AS [0,1,0,0,0,0|2,0,1]=4
12  B10R1.30  O=CC1=CC(O)=CC=C1O HY-N1673 [1,1,0,0,0,0|0,0,0]=2
13  B10R1.30  O=CC1=NC(Br)=CC=C1F HY-W058423 [1,1,0,0,0,0|2,0,0]=4
14  B10R1.61  O=C(O)[13C]1=[13C](O)[13CH]=[13CH][13CH]=[13CH]1 HY-B0167S1 [1,1,0,0,0,0|0,0,0]=2
15  B10R1.14  COC(=O)C1=CC=C(Br)N1 HY-W006646 [0,1,0,0,1,0|2,0,0]=4
16  B12R1.225  C[C@H](C(=O)O)C1=CC(Br)=CC=C1 HY-W442377 [0,1,0,0,0,1|1,0,0]=3
17  B12R1.17  CNCC(=O)C1=CC(O)=CC=C1 HY-Z6449 [0,2,0,0,0,0|1,0,0]=3
18  B12R1.894  O=C(O)[13C]1=[13C](Cl)[13CH]=[13CH][13C](Cl)=[13C]1O HY-W104549S [0,2,0,0,0,0|1,0,0]=3
19  B12R1.453  O=CC1=CC(C(=O)O)=C(F)C=C1 HY-41559 [0,2,0,0,0,0|0,0,1]=3
20  B12R1.279  O=C(O)C1=CC=CC(CCO)=C1 HY-W104310 [0,2,0,0,0,0|0,0,0]=2
21  B10R1.66  O=C(O)\C=C/C1=CN=CN1 HY-113008A [0,0,1,1,0,0|2,0,0]=4
22  B10R1.66  O=[13C](O)\[13CH]=[13CH]/C1=CN=CN1 HY-113008AS [0,0,1,1,0,0|2,0,0]=4
23  B12R1.226  CC1=CC=CC(\C=C\C(=O)O)=C1 HY-78087 [0,0,0,0,0,2|1,0,0]=3