Mol:BMXXSX--d020
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
5 4 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
2.8660 -0.0000 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
3.7321 1.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
4 1 1 0 0 0 0
2 3 1 0 0 0 0
3 5 1 0 0 0 0
S SKP 7
ID BMXXSX--d020
NAME trans-1,3-Dichloro-propene
FORMULA C3H4Cl2
EXACTMASS 109.969
AVERAGEMASS 110.9692
SMILES ClCC=CCl
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06609
M END
