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CAS Number: 17826-11-8
ethyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate

Structure

 ethyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate
Name: ethyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate
Synonyms:
General Information
Product Number: 17826118

CAS Registry Number 17826-11-8
Name:
1H-?Indole-?3-?acetic acid, 5-?bromo-?α-?oxo-?, ethyl ester
Indole-3-glyoxylic acid, 5-bromo-, ethyl ester (8CI)

 

Chemical Formula: C12H10BrNO3
Exact Mass: 294.98
Molecular Weight: 296.12
m/z: 294.98 (100.0%), 296.98 (97.3%), 295.99 (13.2%), 297.99 (13.0%), 296.99 (1.4%), 298.99 (1.4%)

 

InChI:InChI=1S/C12H10BrNO3/c1-2-17-12(16)11(15)9-6-14-10-4-3-7(13)5-8(9)10/h3-6,14H,2H2,1H3

InChI Key:BUQBKBPIDKCCOZ-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C(=O)C1=CNC2=C1C=C(C=C2)Br

Specification

98%
References

PCT Int. Appl. (2011), WO 2011073091 A1 20110623.                                  

PCT Int. Appl. (2003), WO 2003045926 A1 20030605. 
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