Product Name1-NITROBUT-1-ENE
CAS27675-37-2
Molecular FormulaC4H7NO2
Molecular Weight101.1
InChIInChI=1S/C4H7NO2/c1-2-3-4-5(6)7/h3-4H,2H2,1H3/b4-3+
InChIKey UTANVCZNJLPXGK-ONEGZZNKSA-N
SmilesC(/[N+]([O-])=O)=C\CC
Parameter ppm Hz
D(A) 1.26 D(B) 2.33 D(C) 7.24 D(D) 6.92 J(A,B) 7.3 J(A,C) 0.0 J(A,D) 0.0 J(B,C) 6.7 J(B,D) -1.5 J(C,D) 13.5 DESCOTES,G. ET AL. BULL.SOC.CHIM.FR. 1970, 282
1-NITROBUT-1-ENE(27675-37-2) 1H NMR Atlas of Related Products
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