Mol:LBF14000BC06
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
17 16 0 0 1 0 0 0 0 0999 V2000
-3.6829 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0994 2.8480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
1.7263 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0994 2.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4469 2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4469 0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4469 -0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 -1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4469 -2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 -2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4469 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2718 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6829 3.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6829 2.1360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
2 4 1 4 0 0 0
1 5 1 0 0 0 0
2 14 1 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
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
3 15 1 0 0 0 0
15 16 2 0 0 0 0
15 17 1 0 0 0 0
S SKP 5
ID LBF14000BC06
FORMULA C15H30O2
EXACTMASS 242.22458020399998
AVERAGEMASS 242.3975
SMILES CCCCCCCCCCCC(C)CC(O)=O
M END
