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CAS Number: 25028-32-4
ethyl 2-acetylisonicotinate

Structure

ethyl 2-acetylisonicotinate
Name: ethyl 2-acetylisonicotinate
Synonyms:
General Information
Product Number: 25028324

CAS Registry Number 25028-32-4
Name:
4-?Pyridinecarboxylic acid, 2-?acetyl-?, ethyl ester
Isonicotinic acid, 2-acetyl-, ethyl ester (8CI)

 

Chemical Formula: C10H11NO3
Exact Mass: 193.07
Molecular Weight: 193.20
m/z: 193.07 (100.0%), 194.08 (11.1%), 195.08 (1.2%)

 

InChI:InChI=1S/C10H11NO3/c1-3-14-10(13)8-4-5-11-9(6-8)7(2)12/h4-6H,3H2,1-2H3

InChI Key:LUMZQFHOBXCXOR-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=CC(=NC=C1)C(=O)C

Specification

98%

References

PCT Int. Appl. (2013), WO 2013035630 A1 20130314.

Tetrahedron (2015), 71(33), 5238-5247.

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