产品名称 4-硝基苯偶氮
CAS号607-96-5
分子式C13H11N3O4
分子量273.24
InChIInChI=1S/C13H11N3O4/c1-8-6-11(17)7-12(18)13(8)15-14-9-2-4-10(5-3-9)16(19)20/h2-7,17-18H,1H3
InChIKeyXDOOUKIUNUWEFT-UHFFFAOYSA-N
SmilesC1(O)=CC(C)=C(N=NC2=CC=C([N+]([O-])=O)C=C2)C(O)=C1
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Assign. Shift(ppm) A 14.72 B 11.14 C 8.352 D 7.962 E 6.442 F 6.094 G 2.51 Assigned with 2D spectra.Peak G overlapped to the solvent peak. The solvent peak was not deleted completely. The part of residual water peak was removed from this spectrum.
ppm Int. Assign. 166.27 113 1 162.28 491 2 152.66 298 3 146.17 294 4 144.38 496 5 131.86 391 6 125.18 1000 7 120.76 778 8 112.93 259 9 101.29 440 10 17.65 712 11 Assigned with 2D spectra.
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