(2S)-2-(2,5-Difluorophenyl)-1-[(S)-(1,1-dimethylethyl)sulfinyl]pyrrolidine结构式

中文名称:(2S)-2-(2,5-Difluorophenyl)-1-[(S)-(1,1-dimethylethyl)sulfinyl]pyrrolidine
英文名称:1-[(S)-Tert-butylsulfinyl]-2-(2,5-difluorophenyl)pyrrolidine
CAS No.:1443538-32-6
分子式:C14H19F2NOS 分子量:287.368569612503
(2S)-2-(2,5-Difluorophenyl)-1-[(S)-(1,1-dimethylethyl)sulfinyl]pyrrolidine 数据
Mol:
 0  0  0
    6.9784    2.2715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9044    0.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5661    2.3455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -2.3455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  2  0
  1  5  1  0
  1 10  1  6
  2 15  1  0
  3 17  1  0
  5  6  1  0
  5  8  1  0
  6  7  1  0
  6 11  1  0
  7  9  1  0
  8  9  1  0
 10 12  1  0
 10 13  1  0
 10 14  1  0
 11 15  2  0
 11 16  1  0
 15 18  1  0
 16 17  2  0
 17 19  1  0
 18 19  2  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。
(2S)-2-(2,5-Difluorophenyl)-1-[(S)-(1,1-dimethylethyl)sulfinyl]pyrrolidine Smile 编码:
[S@](C(C)(C)C)(N1CCCC1C1C=C(C=CC=1F)F)=O
(2S)-2-(2,5-Difluorophenyl)-1-[(S)-(1,1-dimethylethyl)sulfinyl]pyrrolidine InChi 编码:
1S/C14H19F2NOS/c1-14(2,3)19(18)17-8-4-5-13(17)11-9-10(15)6-7-12(11)16/h6-7,9,13H,4-5,8H2,1-3H3/t13?,19-/m0/s1
(2S)-2-(2,5-Difluorophenyl)-1-[(S)-(1,1-dimethylethyl)sulfinyl]pyrrolidine InChiKey 编码:
KNGQIERPRIBUMA-YFKXAPIDSA-N