-ISIS-  05031710462D

 16 18  0  0  0  0  0  0  0  0999 V2000
    4.9417   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9417   -7.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7333   -7.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5250   -7.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5250   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7333   -5.7458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3167   -7.5750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1083   -7.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1083   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3167   -5.7458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8958   -7.5750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1500   -7.5750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3583   -7.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3583   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7333   -4.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5250   -4.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  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  5  1  0  0  0  0
  8 11  2  0  0  0  0
 12  2  1  0  0  0  0
 13 12  1  0  0  0  0
 13 14  2  0  0  0  0
 14  1  1  0  0  0  0
  6 15  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Catalog No.>
CFN98766

>  <Name>
Bergapten

>  <CAS Number>
484-20-8

>  <Purity>
98%

>  <Formula>
C12H8O4

>  <Mol Weight>
216.2 

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Bergapten-CFN98766.html

$$$$