Mol:LBF20406AM10
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
26 25 0 0 0 0 0 0 0 0999 V2000
-3.9521 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9521 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1271 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1271 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4135 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6999 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4135 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6999 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8749 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8749 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1612 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3646 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5524 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1612 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5524 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2661 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9797 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6933 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2661 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9797 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6937 -0.1121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.9804 1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6464 0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3646 -0.1056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6901 1.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6027 -0.5234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 3 2 0 0 0 0
2 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
3 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
6 10 2 0 0 0 0
9 11 1 0 0 0 0
2 12 1 0 0 0 0
1 12 1 0 0 0 0
11 13 1 0 0 0 0
14 10 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
13 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
20 22 2 0 0 0 0
21 23 1 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
23 26 1 0 0 0 0
S SKP 5
ID LBF20406AM10
FORMULA C24H41NO
EXACTMASS 359.318814939
AVERAGEMASS 359.58847999999995
SMILES C(=CCCCC(NC(C)(C)C)=O)CC=CCC=CCC=CCCCCC
M END
</pre>
