CAS Registry Number: 512822-27-4

Name:

9-​Azabicyclo[3.3.1]​nonane-​9-​carboxylic acid, 3-​oxo-​, 1,​1-​dimethylethyl ester
3-​Oxo-​9-​azabicyclo[3.3.1]​nonane-​9-​carboxylic acid tert-​butyl ester 

Chemical Formula: C13H21NO3
Exact Mass: 239.15
Molecular Weight: 239.31
m/z: 239.15 (100.0%), 240.16 (14.4%), 241.16 (1.6%)
Elemental Analysis: C, 65.25; H, 8.84; N, 5.85; O, 20.06

InChI: InChI=1S/C13H21NO3/c1-13(2,3)17-12(16)14-9-5-4-6-10(14)8-11(15)7-9/h9-10H,4-8H2,1-3H3
InChIKey: YEKYAQUJESJBFI-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1C2CCCC1CC(=O)C2

Specification

98%

PCT Int. Appl. (2014), WO 2014045031 A1 20140327.                                 

PCT Int. Appl. (2011), WO 2011090935 A1 20110728.