CAS Registry Number: 927181-98-4

Name:

1H-​Indole-​7-​carboxylic acid, 3-​formyl-​, ethyl ester

Chemical Formula: C12H11NO3
Exact Mass: 217.07
Molecular Weight: 217.22
m/z: 217.07 (100.0%), 218.08 (13.2%), 219.08 (1.4%)

InChI: InChI=1S/C12H11NO3/c1-2-16-12(15)10-5-3-4-9-8(7-14)6-13-11(9)10/h3-7,13H,2H2,1H3
InChIKey: XUTDEDCNVFAAEQ-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CC=CC2=C1NC=C2C=O

Specification

98%

Youji Huaxue (2006), 26(4), 563-567.