Mol:LBF14000BC08
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
18 17 0 0 1 0 0 0 0 0999 V2000
-1.6537 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4940 1.7846 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-1.2078 0.9753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4940 1.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8097 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2219 2.4985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2219 1.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3292 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9170 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3292 0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9170 -0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3292 -1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9170 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3292 -2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0051 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4172 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2415 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6537 0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 4 1 0 0 0 0
3 4 1 0 0 0 0
5 6 2 0 0 0 0
5 7 1 0 0 0 0
1 8 1 0 0 0 0
2 14 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
2 15 1 4 0 0 0
5 18 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 LBF14000BC08
FORMULA C16H32O2
EXACTMASS 256.240230268
AVERAGEMASS 256.42408
SMILES CCCCCCCCC(CC)CCCCC(O)=O
M END
