Mol:LBF14000HO01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
17 16 0 0 1 0 0 0 0 0999 V2000
2.4047 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9877 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.6147 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2019 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6202 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8218 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2388 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6557 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0727 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5103 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0932 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6762 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2868 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0352 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6185 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2019 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9877 -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
2 17 1 4 0 0 0
S SKP 5
ID LBF14000HO01
FORMULA C14H28O3
EXACTMASS 244.203844762
AVERAGEMASS 244.37032
SMILES CCCCCCCCCCCCC(O)C(O)=O
M END
