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3,4,5-trimethyloxazole(10557-82-1) 1H NMR
Product Name3,4,5-trimethyloxazole
CAS10557-82-1
Molecular FormulaC6H9NO
Molecular Weight111.14
InChIInChI=1S/C6H9NO/c1-4-5(2)7-8-6(4)3/h1-3H3
InChIKey MGHKWBQZEBMFOH-UHFFFAOYSA-N
SmilesO1C(C)=C(C)C(C)=N1
-
Parameter ppm Hz
D(A) 2.050 D(B) 1.809 D(C) 2.184 J(A,B) 0.0 J(A,C) -0.20 J(B,C) 0.70 WASYLISHEN,R.E. ET AL. CAN.J.CHEM. 52, 833 (1974)Spectral Code: 1H NMR : parameter in CS2