Mol:LBF18000BC09
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 0 0 0 0 0 0999 V2000
-1.1580 4.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5848 4.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5848 4.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7459 4.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1580 5.3539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1580 3.9262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 4.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2610 3.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 3.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2610 2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2610 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2610 -0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 -1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2610 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 -2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2610 -3.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 -3.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2610 -4.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1511 -5.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
3 2 1 0 0 0 0
4 5 2 0 0 0 0
4 6 1 0 0 0 0
2 7 1 0 0 0 0
4 21 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
17 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
S SKP 5
ID LBF18000BC09
FORMULA C19H38O2
EXACTMASS 298.28718046
AVERAGEMASS 298.50382
SMILES CC(C)CCCCCCCCCCCCCCCC(O)=O
M END
</pre>
