Mol:BMCCPPPY0003
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
9 9 0 0 0 0 0 0 0 0999 V2000
3.1590 -0.0861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.9680 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7770 -0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4680 0.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4680 0.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2079 -0.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.3733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9680 -1.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8802 1.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5 1 1 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
2 8 2 0 0 0 0
5 9 2 0 0 0 0
1 6 1 0 0 0 0
6 7 1 0 0 0 0
S SKP 7
ID BMCCPPPY0003
NAME N-Ethyl-maleimide
FORMULA C6H7NO2
EXACTMASS 125.0476
AVERAGEMASS 125.1253
SMILES CCn(c(=O)1)c(=O)cc1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02441
M END
</pre>
