Mol:LBF08103BC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
11 10 0 0 1 0 0 0 0 0999 V2000
-1.6160 -0.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6156 -1.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1994 0.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7992 -0.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2566 0.1043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7113 -0.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6160 -0.2056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1994 0.3778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1994 -0.7889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3413 0.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3413 1.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
3 1 1 0 0 0 0
2 4 1 0 0 0 0
4 5 1 0 0 0 0
6 5 1 4 0 0 0
6 7 1 0 0 0 0
7 8 2 0 0 0 0
7 9 1 0 0 0 0
2 10 2 0 0 0 0
10 11 1 0 0 0 0
S SKP 5
ID LBF08103BC01
FORMULA C9H16O2
EXACTMASS 156.11502975599998
AVERAGEMASS 156.22214
SMILES CCC(C)=CCCCC(O)=O
M END
