Mol:BMFYB4ALr001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
6 5 0 0 1 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 3 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 -1.5000 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
3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4 3 1 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 6 2 0 0 0 0
2 5 1 4 0 0 0
S SKP 7
ID BMFYB4ALr001
NAME 2-Methyl-butyraldehyde
FORMULA C5H10O
EXACTMASS 86.0731
AVERAGEMASS 86.1323
SMILES CCC(C)C=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02223
M END
