Product Name[1]Benzothieno[2,3-c]pyridine
CAS244-90-6
Molecular FormulaC11H7NS
Molecular Weight185.24
InChIInChI=1S/C11H7NS/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7H
InChIKey XYABUWLMFQFJND-UHFFFAOYSA-N
SmilesC1=NC=CC2C3=CC=CC=C3SC1=2
Parameter ppm Hz
D(A) 9.068 D(B) 8.563 D(C) 7.829 J(A,B) 0.1 J(A,C) 1.02 J(B,C) 5.35 D(D) 7.919 D(E) 7.592 D(F) 7.521 D(G) 8.244 J(D,E) 7.60 J(D,F) 1.16 J(D,G) 0.86 J(E,F) 7.31 J(E,G) 1.36 J(F,G) 7.78 ROQUES,B.P. ET AL. ORG.MAGN.RESON. 9, 185 (1977)
[1]Benzothieno[2,3-c]pyridine(244-90-6) 1H NMR Atlas of Related Products
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