Mol:BMMCHC--f004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 6 6 0 0 0 0 0 0 0 0999 V2000 2.0000 -0.5000 0.0000 S 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 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.5000 0.0000 S 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 5 4 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 S SKP 7 ID BMMCHC--f004 NAME 1,4-Dithiane FORMULA C4H8S2 EXACTMASS 120.0067 AVERAGEMASS 120.2383 SMILES C(C1)SCCS1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01871 M END