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CAS Number: 50820-64-9
ethyl 1H-indole-6-carboxylate

Structure

ethyl 1H-indole-6-carboxylate
Name: ethyl 1H-indole-6-carboxylate
Synonyms:
General Information
Product Number: 50820649
CAS Registry Number: 50820-64-9
Name:
1H-​Indole-​6-​carboxylic acid, ethyl ester
Indole-​6-​carboxylic acid, ethyl ester (6CI); 6-​Ethoxycarbonyl-​1H-​indole 
 
Chemical Formula: C11H11NO2
Exact Mass: 189.08
Molecular Weight: 189.21
m/z: 189.08 (100.0%), 190.08 (12.3%)
Elemental Analysis: C, 69.83; H, 5.86; N, 7.40; O, 16.91
 
InChI: InChI=1S/C11H11NO2/c1-2-14-11(13)9-4-3-8-5-6-12-10(8)7-9/h3-7,12H,2H2,1H3
InChIKey: MHAKZTRHBLCYKV-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CC2=C(C=C1)C=CN2

Specification

98%

References

PCT Int. Appl. (2011), WO 2011016528 A1 20110210.

PCT Int. Appl. (2002), WO 2002078693 A2 20021010. 

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