public_id

FDB004507

IUPAC 名称

hex-2-en-1-yl hexanoate

描述

Hex-trans-2-enyl hexanoate is a member of the class of compounds known as fatty acid esters. Fatty acid esters are carboxylic ester derivatives of a fatty acid. Hex-trans-2-enyl hexanoate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Hex-trans-2-enyl hexanoate can be found in tea, which makes hex-trans-2-enyl hexanoate a potential biomarker for the consumption of this food product.

CAS号

异构

CCCCCC(=O)OCC=CCCC

InChI标识符

InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h7,9H,3-6,8,10-11H2,1-2H3

键

UQPLEMTXCSYMEK-UHFFFAOYSA-N

平均分子量

198.161979948

id

4508

含有化合物的食物

食物id	食物名称
38	Tea
957	Red tea
1021	Herbal tea
940	Green tea
939	Black tea