Mol:LBF14000BC05
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
17 16 0 0 1 0 0 0 0 0999 V2000
-1.0276 1.4288 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-1.0276 0.6694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3729 1.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3729 -2.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5480 -2.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1355 -1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3105 -1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8980 -0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0731 -0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3394 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1643 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5768 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4018 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8143 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1313 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2811 2.1433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2811 0.7144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 4 0 0 0
1 4 1 0 0 0 0
3 14 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
1 15 1 0 0 0 0
15 16 2 0 0 0 0
15 17 1 0 0 0 0
S SKP 5
ID LBF14000BC05
FORMULA C15H30O2
EXACTMASS 242.22458020399998
AVERAGEMASS 242.3975
SMILES CCCCCCCCCCCCC(C)C(O)=O
M END
