2,7-硝基芴(5405-53-8)Raman光譜
分子式:C13H8N2O4
分子量: 256.21
InChI:InChI=1S/C13H8N2O4/c16-14(17)10-1-3-12-8(6-10)5-9-7-11(15(18)19)2-4-13(9)12/h1-4,6-7H,5H2
InChIKey: IHZCVUBSTYOFSJ-UHFFFAOYSA-N
Smiles:C1C2=C(C=CC([N+]([O-])=O)=C2)C2=C1C=C([N+]([O-])=O)C=C2
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Parameter ppm Hz
D(A) 8.460
D(B) 8.280
D(C) 8.245
J(A,B) 2.10
J(A,C) 0.50
J(B,C) 8.30
D(D) 4.225
MATHIEU,A. ET AL. BULL.SOC.CHIM.FR. 1974, 299
Spectral Code: 1H NMR : parameter in DMSO-d6
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Spectral Code: IR : nujol mull