5-CHLOROSALICYLANILIDE(4638-48-6) 1H NMR
Molecular FormulaC13H10ClNO2
Molecular Weight247.68
InChIInChI=1S/C13H10ClNO2/c14-9-6-7-12(16)11(8-9)13(17)15-10-4-2-1-3-5-10/h1-8,16H,(H,15,17)
InChIKey KGYNGVVNFRUOOZ-UHFFFAOYSA-N
SmilesC(NC1=CC=CC=C1)(=O)C1=CC(Cl)=CC=C1O
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Assign. Shift(ppm)
A *1 11.94
B *1 10.44
C 8.004
D 7.733
E 7.478
F 7.393
G 7.167
J 7.039
J(C,E)=2.8HZ
J(E,J)=8.8HZ
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
165.07 284 1
157.05 331 2
137.91 296 3
133.01 415 4
128.65 1000 5
128.30 474 6
124.29 392 7
122.75 347 8
120.92 882 9
119.21 304 10
119.08 486 11
Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : KBr disc