[1]Benzothieno[3,2-b]pyridine
Product Name
[1]Benzothieno[3,2-b]pyridine
CAS318-69-4
MFC11H7NS
MW185.24
InChIInChI=1S/C11H7NS/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1-7H
InChIKeyWIUZHVZUGQDRHZ-UHFFFAOYSA-N
SmilesC12C3=CC=CC=C3SC1=CC=CN=2
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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)
Spectral Code: 1H NMR : parameter in CDCl3