反式-5-氟哌啶-1,3-二羧酸1-叔丁酯结构式

反式-5-氟哌啶-1,3-二羧酸1-叔丁酯
中文名称:反式-5-氟哌啶-1,3-二羧酸1-叔丁酯
英文名称:trans-5-Fluoro-piperidine-1,3-dicarboxylic acid 1-tert-butyl ester
CAS No.:2703745-63-3
分子式:C11H18FNO4 分子量:247.26
反式-5-氟哌啶-1,3-二羧酸1-叔丁酯 数据
Mol:
  0  0  0  0  0  0  0  0  0  0
    8.5820   -5.0750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4481   -3.5750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3141   -4.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1801   -3.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3141   -5.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1801   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  1  1  0     0  0
  1  7  1  1     0  0
  5  8  1  6     0  0
  8  9  1  0     0  0
  8 10  2  0     0  0
  3 11  1  0     0  0
 11 12  2  0     0  0
 11 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 14 16  1  0     0  0
 14 17  1  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。
反式-5-氟哌啶-1,3-二羧酸1-叔丁酯 Smile 编码:
[C@@H]1(F)C[C@@H](C(=O)O)CN(C(OC(C)(C)C)=O)C1
反式-5-氟哌啶-1,3-二羧酸1-叔丁酯 InChi 编码:
1S/C11H18FNO4/c1-11(2,3)17-10(16)13-5-7(9(14)15)4-8(12)6-13/h7-8H,4-6H2,1-3H3,(H,14,15)/t7-,8-/m1/s1
反式-5-氟哌啶-1,3-二羧酸1-叔丁酯 InChiKey 编码:
VMVJWQZJKYIFJE-HTQZYQBOSA-N