null
  CDK     0224162156
null
 21 22  0  0  0  0  0  0  0  0999 V2000
   -2.9684   -3.9336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -3.9336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7309   -4.6480    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -5.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9684   -5.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9059   -4.6480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4934   -5.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3316   -5.3625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7441   -6.0770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5691   -6.0770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9816   -6.7914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5691   -7.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7441   -7.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3316   -6.7914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9816   -8.2204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8066   -8.2204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2191   -7.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0441   -7.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4566   -8.2204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0441   -8.9349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2191   -8.9349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  3  6  1  0  0  0  0 
  6  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14  9  1  0  0  0  0 
 12 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 18  1  0  0  0  0 
 18 19  2  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  2  0  0  0  0 
 21 16  1  0  0  0  0 
M  END
> <ID>
CHEBI:93414

> <NAME>
N,N-diethyl-2-[4-(phenylmethyl)phenoxy]ethanamine

> <STAR>
2

> <FORMULA>
C19H25NO

> <MASS>
283.409

> <MONOISOTOPIC_MASS>
283.19361

> <CHARGE>
0

> <SMILES>
CCN(CC)CCOC1=CC=C(C=C1)CC2=CC=CC=C2

> <INCHI>
InChI=1S/C19H25NO/c1-3-20(4-2)14-15-21-19-12-10-18(11-13-19)16-17-8-6-5-7-9-17/h5-13H,3-4,14-16H2,1-2H3

> <INCHIKEY>
NFIXBCVWIPOYCD-UHFFFAOYSA-N

> <LINCS_ACCESSION>
LSM-3805

$$$$