-OEChem-01131113492D

 20 19  0     0  0  0  0  0  0999 V2000
   14.1100   -1.1300    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   13.3200   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4100   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5800   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9900   -1.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6600   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6200   -1.9900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7000   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8700   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0100   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1500   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2500   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4600   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5600   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7700   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8200   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9600   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1300   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2300   -0.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3900   -1.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  CHG  1   1   1
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
1

> <PUBCHEM_SUBSTANCE_ID>
22389641

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
NMRShiftDB

> <PUBCHEM_EXT_DATASOURCE_REGID>
20097206

> <PUBCHEM_SUBSTANCE_SYNONYM>
InChI=1/C19H42N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4/h5-19H2,1-4H3/q+

> <PUBCHEM_XREF_EXT_ID>
20097206

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.nmrshiftdb.org

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.nmrshiftdb.org/portal/js_pane/P-Results/nmrshiftdbaction/showDetailsFromHome/molNumber/20097206

> <PUBCHEM_CID_ASSOCIATIONS>
2681  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$