Mol:BMXXBX--n005
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 5 4 0 0 0 0 0 0 0 0999 V2000 | + | 5 4 0 0 0 0 0 0 0 0999 V2000 |
| − | 4.3208 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3208 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6713 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6713 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3208 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3208 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.9713 -1.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9713 -1.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.6218 -1.1367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6218 -1.1367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 1 3 1 0 0 0 0 | + | 1 3 1 0 0 0 0 |
| − | 1 4 1 0 0 0 0 | + | 1 4 1 0 0 0 0 |
| − | 4 5 3 0 0 0 0 | + | 4 5 3 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMXXBX--n005 | + | ID BMXXBX--n005 |
| − | NAME Isobutyro-nitrile | + | NAME Isobutyro-nitrile |
| − | FORMULA C4H7N | + | FORMULA C4H7N |
| − | EXACTMASS 69.0578 | + | EXACTMASS 69.0578 |
| − | AVERAGEMASS 69.1051 | + | AVERAGEMASS 69.1051 |
| − | SMILES N#CC(C)C | + | SMILES N#CC(C)C |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02420 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02420 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
5 4 0 0 0 0 0 0 0 0999 V2000
4.3208 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6713 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3208 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9713 -1.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6218 -1.1367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 0 0 0 0
1 4 1 0 0 0 0
4 5 3 0 0 0 0
S SKP 7
ID BMXXBX--n005
NAME Isobutyro-nitrile
FORMULA C4H7N
EXACTMASS 69.0578
AVERAGEMASS 69.1051
SMILES N#CC(C)C
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02420
M END
