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5-Ethylisoxazole(30842-91-2) 1H NMR
Product Name5-Ethylisoxazole
CAS30842-91-2
Molecular FormulaC5H7NO
Molecular Weight97.12
InChIInChI=1S/C5H7NO/c1-2-5-3-4-6-7-5/h3-4H,2H2,1H3
InChIKey UTHNXNFIWJXWCI-UHFFFAOYSA-N
SmilesO1C(CC)=CC=N1
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Parameter ppm Hz
D(A) 8.079 D(B) 5.978 D(C) 2.718 D(D) 1.224 J(A,B) 1.74 J(A,C) 0.59 J(A,D) 0.00 J(B,C) -0.91 J(B,D) 0.00 J(C,D) 7.60 WASYLISHEN,R.E. ET AL. CAN.J.CHEM. 52, 833 (1974)Spectral Code: 1H NMR : parameter neat