KEGG   COMPOUND: C02455
Entry
C02455                      Compound                               
Name
1-Phenylethylamine;
alpha-Phenylethylamine;
alpha-Methylbenzylamine
Formula
C8H11N
Exact mass
121.0891
Mol weight
121.1796
Structure
Other DBs
CAS: 98-84-0 618-36-0
PubChem: 5475
ChEBI: 670
NIKKAJI: J138.892D J66.056F
KCF data

ATOM        9
            1   C8y C    18.4751  -14.7899
            2   C8x C    17.2532  -15.5002
            3   C8x C    18.4751  -13.3825
            4   C1c C    19.6780  -15.4809
            5   C8x C    16.0504  -14.7899
            6   C8x C    17.2532  -12.6850
            7   C1a C    20.8871  -14.7836
            8   N1a N    19.6843  -16.8755
            9   C8x C    16.0504  -13.3825
BOND        9
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     4   8 1
            8     5   9 1
            9     6   9 2

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Chemical substance (8)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   HSDB (1)   
   MASSBANK (2)   
   NIKKAJI (2)   
All databases (8)   

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