Mol:LBF12103SC01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 14 13 0 0 0 0 0 0 0 0999 V2000 | + | 14 13 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.5960 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5960 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2092 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2092 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9242 -0.5658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9242 -0.5658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2092 0.6731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2092 0.6731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9910 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9910 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3585 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3585 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7067 -0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7067 -0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0440 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0440 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5926 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5926 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2265 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2265 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8838 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8838 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5561 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5561 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2546 -0.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2546 -0.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9242 -0.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9242 -0.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 2 4 2 0 0 0 0 | + | 2 4 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 1 5 1 0 0 0 0 | + | 1 5 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF12103SC01 | + | ID LBF12103SC01 |
| − | FORMULA C12H22O2 | + | FORMULA C12H22O2 |
| − | EXACTMASS 198.16197994799998 | + | EXACTMASS 198.16197994799998 |
| − | AVERAGEMASS 198.30187999999998 | + | AVERAGEMASS 198.30187999999998 |
| − | SMILES CCC=CCCCCCCCC(O)=O | + | SMILES CCC=CCCCCCCCC(O)=O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
14 13 0 0 0 0 0 0 0 0999 V2000
2.5960 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2092 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9242 -0.5658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2092 0.6731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9910 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3585 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7067 -0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0440 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5926 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2265 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8838 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5561 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2546 -0.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9242 -0.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
2 4 2 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
1 5 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
11 12 2 0 0 0 0
10 11 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
S SKP 5
ID LBF12103SC01
FORMULA C12H22O2
EXACTMASS 198.16197994799998
AVERAGEMASS 198.30187999999998
SMILES CCC=CCCCCCCCC(O)=O
M END
