-OEChem-03311014132D

 26 26  0     0  0  0  0  0  0999 V2000
    0.5000   -1.7504    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5299   -0.1355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4899   -2.6204    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4599    0.7044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3799   -0.1234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4099    1.4914    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0599   -1.4204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0599   -0.4855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4899   -1.7504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4599   -0.1355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8700   -1.8904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8700   -0.0205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6799   -1.4204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6799   -0.4905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9699   -0.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    0.6775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9099   -0.9375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9399    0.6775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3199   -0.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3499    1.4914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7899    0.6905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8199    2.3054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7300    0.6905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7599    2.3054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1999    1.5045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2300    3.1194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 15  1  0  0  0  0
  2 10  1  0  0  0  0
  2 16  1  0  0  0  0
  3  9  2  0  0  0  0
  4 10  2  0  0  0  0
  5 17  1  0  0  0  0
  5 19  1  0  0  0  0
  6 18  1  0  0  0  0
  6 20  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  7 11  1  0  0  0  0
  8 10  1  0  0  0  0
  8 12  1  0  0  0  0
 11 13  2  0  0  0  0
 12 14  2  0  0  0  0
 13 14  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
24869646

> <PUBCHEM_SUBSTANCE_VERSION>
3

> <PUBCHEM_EXT_DATASOURCE_NAME>
Sigma-Aldrich

> <PUBCHEM_EXT_DATASOURCE_REGID>
460095_ALDRICH

> <PUBCHEM_SUBSTANCE_SYNONYM>
460095_ALDRICH
Bis(2-butoxyethyl) phthalate

> <PUBCHEM_XREF_EXT_ID>
460095_ALDRICH

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.sigmaaldrich.com?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.sigmaaldrich.com/catalog/search/ProductDetail/ALDRICH/460095?cm_mmc=affiliate-_-PubChem-_-product-_-link

> <PUBCHEM_CID_ASSOCIATIONS>
8345  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$