甲位己基桂醛结构式

中文名称:甲位己基桂醛
英文名称:α-Hexylcinnamaldehyde
CAS No.:101-86-0
分子式:C15H20O 分子量:216.3187
甲位己基桂醛 数据
Mol:
  4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4386    5.4950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790    4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7193    5.4950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.4950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  2  1  0  0  0  0
  1  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
M  END                                
  如需查看或获取完整mol文件,请关注官方微信公众号(微信搜一搜:Chem960),回复CAS号+“mol”(如回复:98-98-6 mol)免费获取。
甲位己基桂醛 Smile 编码:
C(=C(/CCCCCC)\C=O)/C1C=CC=CC=1
甲位己基桂醛 InChi 编码:
1S/C15H20O/c1-2-3-4-6-11-15(13-16)12-14-9-7-5-8-10-14/h5,7-10,12-13H,2-4,6,11H2,1H3
甲位己基桂醛 InChiKey 编码:
GUUHFMWKWLOQMM-UHFFFAOYSA-N