1,4-Diacetamino-2-nitrobenzene(5345-53-9) IR1
Molecular FormulaC10H11N3O4
Molecular Weight237.21
InChIInChI=1S/C10H11N3O4/c1-6(14)11-8-3-4-9(12-7(2)15)10(5-8)13(16)17/h3-5H,1-2H3,(H,11,14)(H,12,15)
InChIKey WIBLBSKESAEFTC-UHFFFAOYSA-N
SmilesC1(NC(=O)C)=CC=C(NC(=O)C)C=C1[N+]([O-])=O
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Assign. Shift(ppm)
A *1 10.3
B *1 10.1
C 8.327
D 7.752
E 7.547
F *2 2.082
G *2 2.053
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
168.78 435 1 *
168.42 449 2 *
142.31 348 3
136.28 514 4
126.14 1000 5
6
123.96 493 7
114.35 486 8
23.86 630 9 #
23.23 659 10 #
Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : KBr disc