Mol:LBF15000HO01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
18 17 0 0 1 0 0 0 0 0999 V2000
2.6964 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2794 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.9064 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4936 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9119 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1134 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5305 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9474 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3644 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2186 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8016 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3845 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9951 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7435 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3269 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9102 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4936 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2794 -1.0876 0.0000 O 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
3 4 1 0 0 0 0
3 5 2 0 0 0 0
1 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
2 18 1 4 0 0 0
S SKP 5
ID LBF15000HO01
FORMULA C15H30O3
EXACTMASS 258.21949482599996
AVERAGEMASS 258.3969
SMILES CCCCCCCCCCCCCC(O)C(O)=O
M END
