Mol:LBF18207HO02
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 1 0 0 0 0 0999 V2000
-0.7951 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1076 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5513 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2658 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9803 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6947 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4092 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1237 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8381 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5526 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2671 -0.6435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5526 0.5940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4276 -0.1073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2251 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9760 -0.1760 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-3.6826 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3701 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9751 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5526 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2671 -0.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9760 0.6435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 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
10 12 2 0 0 0 0
1 13 1 0 0 0 0
13 14 2 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
15 21 1 4 0 0 0
S SKP 5
ID LBF18207HO02
FORMULA C18H32O3
EXACTMASS 296.23514489
AVERAGEMASS 296.44488
SMILES CCCCCC(O)C=CC=CCCCCCCCC(O)=O
M END
</pre>
