uladane (0.22Hz/2)


Gaussian numbering
1H-1H Js
 -ppm- -#-   H15   H16   H20   H21   H22   H23   H24   H25   H26   H27   H28   H29   H30   H31   H32   H33   H34   H35   H36   H38   
  2.46 H15
  5.94 H16    - 
  2.19 H20    -     - 
  1.06 H21    -     -     - 
  1.06 H22    -     -     -     - 
  2.27 H23   6.6    -     -     -     - 
  1.06 H24    -     -     -     -     -     - 
  1.27 H25    -     -     -    0.7   0.7    -    0.7
  1.18 H26    -     -     -     -     -     -     -     - 
  1.18 H27    -     -     -     -     -     -     -     -     - 
  1.18 H28    -     -     -     -     -     -     -     -     -     - 
  2.09 H29    -   -1.2    -     -     -     -     -     -     -     -     - 
  2.09 H30    -   -1.2    -     -     -     -     -     -     -     -     -     - 
  2.09 H31    -   -1.2    -     -     -     -     -     -     -     -     -     -     - 
  1.97 H32    -   -0.7    -     -     -    6.5    -     -     -     -     -     -     -     - 
  1.27 H33    -     -     -    0.7   0.7    -    0.7    -     -     -     -     -     -     -     - 
  1.27 H34    -     -     -    0.7   0.7    -    0.7    -     -     -     -     -     -     -     -     - 
  3.04 H35    -   -2.5    -     -     -   12.2    -     -     -     -     -   -1.2  -1.2  -1.2 -19.9    -     - 
  2.02 H36    -     -  -12.3    -     -    0.7    -     -     -     -     -     -     -     -     -     -     -     - 
  4.08 H38    -     -     -     -     -    1.0    -     -     -     -     -     -     -     -     -     -     -     -    5.9

13C-1H Js
 -ppm- -#-   H15   H16   H20   H21   H22   H23   H24   H25   H26   H27   H28   H29   H30   H31   H32   H33   H34   H35   H36   H38   
194.76 C1   -6.6   0.7    -     -     -    1.1    -     -     -     -     -   -0.6  -0.6  -0.6  -1.0    -     -   -1.6   1.1    - 
 49.98 C2  133.3   3.5   3.5    -     -   -4.0    -     -    3.7   3.7   3.7    -     -     -    6.5    -     -    0.9   6.5    - 
127.28 C3    2.0 164.8    -     -     -     -     -     -     -     -     -    5.2   5.2   5.2   4.7    -     -    5.1    -     - 
178.16 C4    8.2    -    9.6    -     -     -     -     -    5.6   5.6   5.6    -     -     -     -     -     -     -    1.0   6.0
 43.60 C5   -5.1    -   -3.1    -     -    6.6    -     -   -4.3  -4.3  -4.3    -     -     -     -     -     -     -   -3.0   3.6
 36.80 C6    0.8    -    1.3  -3.4  -3.4  -4.2  -3.4  -3.6    -     -     -     -     -     -    1.0  -3.6  -3.6   2.2   5.1    - 
 42.24 C7    4.4    -  137.4    -     -     -     -     -    4.8   4.8   4.8    -     -     -     -     -     -     -  132.5  -2.0
 42.38 C8   -3.5    -     -    4.6   4.6 129.4   4.6   3.6    -     -     -     -     -     -   -3.7   3.6   3.6  -4.3    -    5.2
163.78 C9     -     -     -     -     -    1.4    -     -     -     -     -   -6.4  -6.4  -6.4  -6.9    -     -   -8.1    -     - 
 18.29 C12   1.3    -    0.6    -     -     -     -     -  131.1 131.1 131.1    -     -     -     -     -     -     -    3.2    - 
 24.09 C13    -    6.3    -     -     -     -     -     -     -     -     -  128.6 128.6 128.6   3.5    -     -    1.7    -     - 
 30.74 C14   6.2   7.0    -     -     -   -4.8    -     -     -     -     -    4.0   4.0   4.0 129.6    -     -  131.3    -     - 
 24.12 C17    -     -     -  127.3 127.3   4.5 127.3   5.4    -     -     -     -     -     -     -    5.4   5.4    -     -    0.8
 23.12 C18    -     -     -    4.9   4.9   0.7   4.9 128.1    -     -     -     -     -     -     -  128.1 128.1    -     -    3.0
 83.25 C19    -     -     -    5.0   5.0   4.9   5.0   4.5    -     -     -     -     -     -     -    4.5   4.5    -   -4.6 156.8
 -ppm- -#-   H15   H16   H20   H21   H22   H23   H24   H25   H26   H27   H28   H29   H30   H31   H32   H33   H34   H35   H36   H38   
1H data (JH-H abs sorted)

5.94 (1.2, 1.2, 1.2, 0.7)
4.08 (5.9, 1.0)
3.04 (12.2, 2.5, 1.2, 1.2)
2.46 (6.6)
2.27 (12.2, 6.6, 6.5, 0.7)
2.19 (12.3)
2.09 (1.2, 1.2)
2.02 (12.3, 5.9, 0.7)
1.97 (19.9, 6.5, 0.7)
1.27 (0.7, 0.7, 0.7)
1.18
1.06 (0.7, 0.7, 0.7)
13C data
  1 194.8 (-6.6, -1.6, 1.1, 1.1)
  4 178.2 (9.6, 8.2, 6.0, 5.6)
  9 163.8 (-8.1, -6.9, -6.4, -6.4)
  3 127.3 (164.8, 5.2, 5.2, 5.2)
 19  83.3 (156.8, 5.0, 5.0, 5.0)
  2  50.0 (133.3, 6.5, 6.5, -4.0)
  5  43.6 (6.6, -5.1, -4.3, -4.3)
  8  42.4 (129.4, 5.2, 4.6, 4.6)
  7  42.2 (137.4, 132.5, 4.8, 4.8)
  6  36.8 (5.1, -4.2, -3.6, -3.6)
 14  30.7 (131.3, 129.6, 7.0, 6.2)
 17  24.1 (127.3, 127.3, 127.3, 5.4)
 13  24.1 (128.6, 128.6, 128.6, 6.3)
 18  23.1 (128.1, 128.1, 128.1, 4.9)
 12  18.3 (131.1, 131.1, 131.1, 3.2)

[ Notes ]
  • apparent typo for H7 in Table1: 4.27 (d, 12.0) - the larger constant on H8/H8' is calculated 5.9Hz