2,6-Piperidinedione, 3-(4-amino-1,3-dihydro-1-oxo-2H-isoindol-2-yl)-, hydrate...
C13H13N3O3.1/2H2O
847871-99-2 Copyright (C) 2024 ACS
 20 21  0  0  0  0  0  0  0  0999 V2000
    4.6078    7.3304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5770    1.9526    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    1.5400    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1970    4.6200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0370    4.6200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1320    5.8659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1320    3.3740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    5.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    3.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    6.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5770    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3470    3.2862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3470    5.9536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8870    3.2862    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8870    5.9536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6570    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5985    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  2  0  0  0  0
  2 15  2  0  0  0  0
  3 11  1  0  0  0  0
  4 19  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 14  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  2  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 13  2  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
> <cas.rn>
847871-99-2

> <cas.index.name>
2,6-Piperidinedione, 3-(4-amino-1,3-dihydro-1-oxo-2H-isoindol-2-yl)-, hydrate (2:1)

> <molecular.formula>
C13H13N3O3.1/2H2O

> <molecular.weight>
536.54

$$$$
