Mol:BMFYS4ALq003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
6 5 0 0 0 0 0 0 0 0999 V2000
3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 3 0 0 0 0
2 1 1 0 0 0 0
1 5 2 0 0 0 0
3 4 1 0 0 0 0
4 6 1 0 0 0 0
S SKP 7
ID BMFYS4ALq003
NAME 4-Hydroxy-2-butynal
FORMULA C4H4O2
EXACTMASS 84.0211
AVERAGEMASS 84.0733
SMILES OCC#CC=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02648
M END
