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CAS Number: 122637-39-2
6-acetylpicolinic acid

Structure

6-acetylpicolinic acid
Name: 6-acetylpicolinic acid
Synonyms:
General Information
Product Number: 122637392
CAS Registry Number: 122637-39-2
Name:
        2-​Pyridinecarboxylic acid, 6-​acetyl-
 
Chemical Formula: C8H7NO3
Exact Mass: 165.04
Molecular Weight: 165.15
m/z: 165.04 (100.0%), 166.05 (8.8%)
Elemental Analysis: C, 58.18; H, 4.27; N, 8.48; O, 29.06
 
InChI: InChI=1S/C8H7NO3/c1-5(10)6-3-2-4-7(9-6)8(11)12/h2-4H,1H3,(H,11,12)
InChIKey: SMFINMWLJMPOES-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=NC(=CC=C1)C(=O)O

Specification

98%

References

(1) Ronson, Tanya K.; Dalton Transactions 2007, (10), P1006-1022 CAPLUS

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