ISOPHTHALAMIDE(1740-57-4) 1H NMR
Molecular FormulaC8H8N2O2
Molecular Weight164.16
InChIInChI=1S/C8H8N2O2/c9-7(11)5-2-1-3-6(4-5)8(10)12/h1-4H,(H2,9,11)(H2,10,12)
InChIKey QZUPTXGVPYNUIT-UHFFFAOYSA-N
SmilesC1(C(N)=O)=CC=CC(C(N)=O)=C1
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![](https://www.chemicalbook.com/Spectrum/1740-57-4_1HNMR_0.jpg)
Assign. Shift(ppm)
A 8.429
B *1 8.12
C 8.041
D 7.570
E *1 7.54
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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![](https://www.chemicalbook.com/Spectrum/1740-57-4_13CNMR_0.jpg)
ppm Int. Assign.
167.61 946 1
134.41 1000 2
130.04 815 3
128.20 457 4
126.75 391 5
Spectral Code: 13C NMR : in DMSO-d6
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![](https://www.chemicalbook.com/Spectrum/1740-57-4_IR1_0.jpg)
Spectral Code: IR : KBr disc
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![](https://www.chemicalbook.com/Spectrum/1740-57-4_Raman_0.jpg)
Spectral Code: Raman : 4880 A,200 M,powder