Product Name[1]Benzothieno[3,2-b]pyridine
CAS318-69-4
Molecular FormulaC11H7NS
Molecular Weight185.24
InChIInChI=1S/C11H7NS/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1-7H
InChIKey WIUZHVZUGQDRHZ-UHFFFAOYSA-N
SmilesC12C3=CC=CC=C3SC1=CC=CN=2
Parameter ppm Hz
D(A) 8.692 D(B) 7.228 D(C) 8.099 J(A,B) 4.6 J(A,C) 1.5 J(B,C) 8.1 D(D) 7.863 D(E) 7.562 D(F) 7.542 D(G) 8.502 J(D,E) 7.72 J(D,F) 1.25 J(D,G) 0.74 J(E,F) 6.97 J(E,G) 1.09 J(F,G) 8.04 ROQUES,B.P. ET AL. ORG.MAGN.RESON. 9, 185 (1977)
[1]Benzothieno[3,2-b]pyridine(318-69-4) 1H NMR Atlas of Related Products
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