Mol:LBF18000BC10
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 1 0 0 0 0 0999 V2000
-0.6738 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3567 2.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5583 4.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4839 5.3322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0713 4.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9479 4.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 4.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 3.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 2.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 2.1168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 1.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 0.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 -0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 -1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 -2.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 -2.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7471 -5.6894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9442 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3567 5.6894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3567 4.2603 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 5 1 0 0 0 0
4 5 1 0 0 0 0
2 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
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 LBF18000BC10
FORMULA C19H38O2
EXACTMASS 298.28718046
AVERAGEMASS 298.50382
SMILES CCCC(C)CCCCCCCCCCCCCC(O)=O
M END
