Product Name2-Bromo-4-formylselenophene
Molecular FormulaC5H3BrOSe
Molecular Weight237.94072
InChIInChI=1S/C5H3BrOSe/c6-5-1-4(2-7)3-8-5/h1-3H
InChIKey ZJKPNPFWWFVBGZ-UHFFFAOYSA-N
Smiles[Se]1C=C(C=O)C=C1Br
Parameter ppm Hz
D(A) 9.254 D(B) 7.712 D(C) 9.716 J(A,B) 1.58 J(A,C) 0.0 J(B,C) 0.37 SIMONNIN,M.P. ET AL. ORG.MAGN.RESON. 8, 508 (1976) J(B,C) IS ABSOLUTE VALUE. J(A,SE-77):40.95HZ. J(B,SE-77):4.45HZ.
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