KEGG   COMPOUND: C16074Help
Entry
C16074                      Compound                               

Name
Phenylacetonitrile;
Benzyl cyanide
Formula
C8H7N
Exact mass
117.0578
Mol weight
117.1479
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Cyanoamino acid metabolism
Styrene degradation
Microbial metabolism in diverse environments
Enzyme
3.5.5.1         4.2.1.84        4.99.1.7
Other DBs
CAS: 
140-29-4
PubChem: 
ChEBI: 
ChEMBL: 
KNApSAcK: 
NIKKAJI: 
KCF data Show

ATOM        9
            1   C8y C    22.9969  -19.9438
            2   C1b C    22.9969  -18.5545
            3   C8x C    21.7932  -20.6415
            4   C8x C    24.2196  -20.6415
            5   C3b C    24.2003  -17.8503
            6   C8x C    21.7932  -22.0499
            7   C8x C    24.2196  -22.0499
            8   N3a N    25.4040  -17.1524
            9   C8x C    22.9969  -22.7606
BOND        9
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 2
            7     5   8 3
            8     6   9 2
            9     7   9 1

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