Mol:BMMCBZ1Ss050
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
8 8 0 0 0 0 0 0 0 0999 V2000
3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 6 2 0 0 0 0
1 2 1 0 0 0 0
1 7 1 0 0 0 0
6 5 1 0 0 0 0
2 3 2 0 0 0 0
7 8 2 0 0 0 0
5 4 2 0 0 0 0
3 4 1 0 0 0 0
S SKP 7
ID BMMCBZ1Ss050
NAME Styrene
FORMULA C8H8
EXACTMASS 104.0626
AVERAGEMASS 104.1491
SMILES C=Cc(c1)cccc1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C07083
M END
