Mol:PR100851

 
  ACD/Labs08070914582D 
 
 12 11  0  0  0  0  0  0  0  0  1 V2000 
   20.3675   -5.2819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   19.1691   -4.6733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   20.3675   -6.9573    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
   21.5722   -4.6733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   17.6043   -5.4303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   21.5411   -7.6279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   22.7272   -5.3811    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   21.5722   -3.4269    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   17.6043   -6.9708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   16.3687   -4.8218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   22.7085   -6.9510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   21.5411   -9.0515    0.0000 O   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 
  2  5  1  0  0  0  0 
  3  6  1  0  0  0  0 
  4  7  1  0  0  0  0 
  4  8  2  0  0  0  0 
  5  9  1  0  0  0  0 
  5 10  2  0  0  0  0 
  6 11  1  0  0  0  0 
  6 12  2  0  0  0  0 
S  SKP  7 
CAS_RN	2545-40-6 
NAME	N-Acetyl-DL-aspartic acid 
ID	PR100851 
FORMULA	C6H9NO5 
EXACTMASS	175.048072403 
AVERAGEMASS	175.13940000000002 
SMILES	CC(=O)NC(CC(O)=O)C(O)=O 
M  END