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4H-Pyran-4-thione(1120-93-0) 1H NMR
Product Name4H-Pyran-4-thione
CAS1120-93-0
Molecular FormulaC5H4OS
Molecular Weight112.15
InChIInChI=1S/C5H4OS/c7-5-1-3-6-4-2-5/h1-4H
InChIKey WWANKXYUVUCOMI-UHFFFAOYSA-N
SmilesC1OC=CC(=S)C=1
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Parameter ppm Hz
D(A) 7.477 D(B) 7.032 J(A,A') 2.20 J(A,B) 5.79 J(A,B') 0.65 J(A',B) 0.65 J(A',B') 5.79 J(B,B') 0.88 JONAS,J. ET AL. PHYS.CHEM. 69, 1 (1965)Spectral Code: 1H NMR : parameter in CDCl3