3-ACETAMIDOPYRIDINE(5867-45-8) IR1
Molecular FormulaC7H8N2O
Molecular Weight136.15
InChIInChI=1S/C7H8N2O/c1-6(10)9-7-3-2-4-8-5-7/h2-5H,1H3,(H,9,10)
InChIKey JVYIBLHBCPSTKF-UHFFFAOYSA-N
SmilesC(NC1=CC=CN=C1)(=O)C
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Parameter ppm Hz
D(A) 8.96
D(B) 8.25
D(C) 7.44
D(D) 8.43
J(A,B) 2.4
J(A,C) 0.5
J(A,D) 0.0
J(B,C) 7.7
J(B,D) 1.3
J(C,D) 4.5
D(E) 10.4
D(F) 2.18
BRUEGEL,W. Z.ELEKTROCHEM.(BER.BUNSENGES.PHYS.CHEM.)
66, 159 (1962)
H(E):BROAD.
Spectral Code: 1H NMR : parameter in DMSO-d6
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Spectral Code: IR : KBr disc