Product Name2-Cyano-4-nitroselenophene
Molecular FormulaC5H2N2O2Se
Molecular Weight201.04158
InChIInChI=1S/C5H2N2O2Se/c6-2-5-1-4(3-10-5)7(8)9/h1,3H
InChIKey ZLVWHYHAWMNLOU-UHFFFAOYSA-N
Smiles[Se]1C=C([N+]([O-])=O)C=C1C#N
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Parameter ppm Hz
D(A) 9.60 D(B) 8.79 J(A,B) 1.78 SIMONNIN,M.P. ET AL. ORG.MAGN.RESON. 8, 508 (1976) J(A,SE-77):37.8HZ. J(B,SE-77):1.12HZ.Spectral Code: 1H NMR : parameter in DMSO-d6