N-ACETYL-N'-PHENYLUREA
Product Name
N-ACETYL-N'-PHENYLUREA
CAS102-03-4
MFC9H10N2O2
MW178.19
InChIInChI=1S/C9H10N2O2/c1-7(12)10-9(13)11-8-5-3-2-4-6-8/h2-6H,1H3,(H2,10,11,12,13)
InChIKeyRUPVBKFFZNPEPS-UHFFFAOYSA-N
SmilesC(NC(NC1=CC=CC=C1)=O)(=O)C
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Assign. Shift(ppm)
A *1 10.7
B *1 10.6
C *1 9.9
D 7.598
E 7.522
F 7.33
G 7.293
J 7.090
K 7.028
L 2.116
M 2.055
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
172.76 86 1
169.05 127 8
151.88 82 2
9
138.19 306 10
137.19 105 3
129.03 357 4
128.90 1000 11
128.79 71 5
124.46 184 12
124.31 254 6
120.52 364 13
24.30 185 14
24.02 137 7
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : KBr disc
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Spectral Code: Raman : 4880 A,200 M,powder
N-ACETYL-N'-PHENYLUREA(102-03-4)Raman Atlas of Related Products