2,2ˊ,4,4ˊ,6,6ˊ-六硝基二苯胺(131-73-7)红外图谱(IR1)
分子式:C12H5N7O12
分子量: 439.21
InChI:InChI=1S/C12H5N7O12/c20-14(21)5-1-7(16(24)25)11(8(2-5)17(26)27)13-12-9(18(28)29)3-6(15(22)23)4-10(12)19(30)31/h1-4,13H
InChIKey: CBCIHIVRDWLAME-UHFFFAOYSA-N
Smiles:C1(NC2=C([N+]([O-])=O)C=C([N+]([O-])=O)C=C2[N+]([O-])=O)=C([N+]([O-])=O)C=C([N+]([O-])=O)C=C1[N+]([O-])=O
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ppm Int. Assign.
141.88 120 1
138.40 622 2
131.76 316 3
124.15 1000 4
Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : KBr disc