Neoisomenthol acetate
IUPAC 名称
(1R,2R,5R)-5-methyl-2-(propan-2-yl)cyclohexyl acetate
描述
Neoisomenthol acetate is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Neoisomenthol acetate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Neoisomenthol acetate can be found in peppermint, which makes neoisomenthol acetate a potential biomarker for the consumption of this food product.
异构
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OC(C)=O
InChI标识符
InChI=1S/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11-,12-/m1/s1
键
XHXUANMFYXWVNG-YUSALJHKSA-N