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8-Hydroxyquinoline sulfate(134-31-6) 1H NMR
Product Name8-Hydroxyquinoline sulfate
CAS134-31-6
Molecular Formula2C9H7NO.H2O4S
Molecular Weight388.4
InChIInChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)
InChIKey YYVFXSYQSOZCOQ-UHFFFAOYSA-N
SmilesC12=CC=CN=C1C(O)=CC=C2.C12=CC=CN=C1C(O)=CC=C2.S(=O)(=O)(O)O
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Assign. Shift(ppm)
A 9.024 B 8.794 C 7.866 D 7.645 E 7.626 F 7.349 G 5.6 J(A,B)=1.7HZ J(A,C)=4.8HZ J(B,C)=8.4HZ J(D,E)=8.2HZ J(E,F)=1.8HZ J(D,F)=7.0HZSpectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
150.64 710 1 146.11 919 2 141.37 559 3 133.36 349 4 129.23 738 5 * 128.98 961 6 * 122.08 936 7 118.11 1000 8 113.68 859 9Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : KBr disc
