Mol:LBF18000BC11
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 1 0 0 0 0 0999 V2000
-1.5558 3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2423 3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2423 3.1747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1598 3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7472 2.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1598 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7472 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1598 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7472 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1598 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7472 -1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1598 -2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7472 -2.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1598 -3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7472 -4.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2572 3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6697 2.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4947 2.8578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1434 3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5558 4.2867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5558 2.8578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 4 0 0 0
1 4 1 0 0 0 0
2 15 1 0 0 0 0
4 5 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
14 15 1 0 0 0 0
2 16 1 0 0 0 0
16 17 1 0 0 0 0
18 17 1 4 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
19 21 1 0 0 0 0
S SKP 5
ID LBF18000BC11
FORMULA C19H38O2
EXACTMASS 298.28718046
AVERAGEMASS 298.50382
SMILES CCCCCCCCCCCCCC(C)CCCC(O)=O
M END
