CAS Registry Number: 54954-73-3
(Component: 38206-86-9)

Name:

1-​Azabicyclo[2.2.2]​octane-​3-​carboxylic acid, methyl ester, hydrochloride (1:1)
1-​Azabicyclo[2.2.2]​octane-​3-​carboxylic acid, methyl ester, hydrochloride (9CI); 3-​Quinuclidinecarboxyl​ic acid, methyl ester, hydrochloride (6CI); Methyl quinuclidine-​3-​carboxylate hydrochloride 

Chemical Formula: C9H16ClNO2
Exact Mass: 205.09
Molecular Weight: 205.68
m/z: 205.09 (100.0%), 207.08 (32.0%), 206.09 (10.0%), 208.09 (3.2%)
Elemental Analysis: C, 52.56; H, 7.84; Cl, 17.24; N, 6.81; O, 15.56

InChI: InChI=1S/C9H15NO2.ClH/c1-12-9(11)8-6-10-4-2-7(8)3-5-10;/h7-8H,2-6H2,1H3;1H
InChIKey: NDTQASSGEAZYOT-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1CN2CCC1CC2.Cl

Specification

98%

1. (1) Grob, C. A.; Helvetica Chimica Acta 1954, V37, P1689-98 CAPLUS
2. (2) Grob, Cyril A.; CH 328904 1958 CAPLUS