CAS Registry Number: 192189-17-6

Name:

1H-​Pyrrolo[2,​3-​c]​pyridine-​1-​carboxylic acid, 3-​bromo-​, 1,​1-​dimethylethyl ester

Chemical Formula: C12H13BrN2O2
Exact Mass: 296.02
Molecular Weight: 297.15
m/z: 296.02 (100.0%), 298.01 (97.3%), 297.02 (13.2%), 299.02 (12.9%), 298.02 (1.3%), 300.02 (1.2%)

InChI: InChI=1S/C12H13BrN2O2/c1-12(2,3)17-11(16)15-7-9(13)8-4-5-14-6-10(8)15/h4-7H,1-3H3
InChIKey: GYYPHTDECKDRTB-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1C=C(C2=C1C=NC=C2)Br

Specification

98%

U.S. Pat. Appl. Publ. (2007), US 20070254867 A1 20071101. 

Journal of Medicinal Chemistry (1997), 40(15), 2430-2433.