## Abstract The ^13^C spectra of α‐thujene (**1**), isothujone (**2**), (−)isothujol (**3**), (+)neoisothujol (**4**), sabinol (**5**), dihydroumbellulone (**6**) and umbellulone (**7**) and the alcohol acetates are recorded and assigned. The C‐6 chemical shift may be used in conjunction with the s
The conformations of bicyclo[3.1.0]hexane derivatives by 1H and 13C NMR
✍ Scribed by John C. Rees; David Whittaker
- Publisher
- John Wiley and Sons
- Year
- 1981
- Tongue
- English
- Weight
- 601 KB
- Volume
- 15
- Category
- Article
- ISSN
- 0749-1581
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✦ Synopsis
Abstract
The ^1^H and ^13^C spectra of bicyclo[3.1.0]hexanes and thujanes have been recorded and assigned. Application of the Karplus equation has yielded dihedral angles, and a computer calculation of the angle of ring buckle as a function of the main dihedral angles has been carried out. The calculated angles of ring buckle agree well with known values in the bicyclo[3.1.0]hexanes, but for 1‐methylbicyclo[3.1.0]hexanes and thujanes the results are not self consistent. It is suggested that the bridgehead substituent causes the boat to twist, although the twist can be reduced by an axial methyl substituent on C‐4.
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