Mol:LBF16000SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
18 17 0 0 0 0 0 0 0 0999 V2000
4.6166 -0.1526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3316 -0.5637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6166 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0033 -0.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3158 -0.1155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6544 -0.6091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9862 -0.1279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3262 -0.6201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6552 -0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0076 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6758 -0.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3358 -0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0068 -0.1595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6696 -0.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3378 -0.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9978 -0.6641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6688 -0.1815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3316 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 2 0 0 0 0
4 1 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
15 16 1 0 0 0 0
16 17 1 0 0 0 0
17 18 1 0 0 0 0
S SKP 5
ID LBF16000SC01
FORMULA C16H32O2
EXACTMASS 256.240230268
AVERAGEMASS 256.42408
SMILES CCCCCCCCCCCCCCCC(O)=O
M END
