Mol:LBF11101SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
13 12 0 0 0 0 0 0 0 0999 V2000
2.2612 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8744 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5894 -0.5844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8744 0.6545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6562 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0237 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3719 -0.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2908 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9274 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5613 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2186 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8909 -0.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5894 -0.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
2 4 2 0 0 0 0
5 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
1 5 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
11 12 1 0 0 0 0
10 11 1 0 0 0 0
12 13 2 0 0 0 0
S SKP 5
ID LBF11101SC01
FORMULA C11H20O2
EXACTMASS 184.14632988399998
AVERAGEMASS 184.2753
SMILES C=CCCCCCCCCC(O)=O
M END
