Mol:LBF16106SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
18 17 0 0 0 0 0 0 0 0999 V2000
3.7978 -0.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4110 -0.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1260 -0.5878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4110 0.6511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1928 -0.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5603 -0.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9085 -0.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2458 -0.5933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6091 -0.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0247 -0.5933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6022 -0.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2746 -0.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0597 -0.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6647 -0.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2147 -0.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8596 -0.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4811 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1260 -0.1382 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
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 2 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
17 18 1 0 0 0 0
S SKP 5
ID LBF16106SC01
FORMULA C16H30O2
EXACTMASS 254.22458020399998
AVERAGEMASS 254.4082
SMILES CCCCCC=CCCCCCCCCC(O)=O
M END
