双水杨酸酯(552-94-3)核磁图(1HNMR)
InChI:InChI=1S/C14H10O5/c15-11-7-3-1-5-9(11)14(18)19-12-8-4-2-6-10(12)13(16)17/h1-8,15H,(H,16,17)
InChIKey: WVYADZUPLLSGPU-UHFFFAOYSA-N
Smiles:C(OC1=CC=CC=C1C(O)=O)(=O)C1=CC=CC=C1O
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Assign. Shift(ppm)
A *1 10.73
B *1 10.25
C *2 8.12
D *2 8.05
E *3 7.63
F *3 7.50
G *4 7.37
J *5 7.25
K *5 7.01
L *4 6.91
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
169.76 756 1
168.76 577 2
161.96 1000 3
150.45 870 4
136.42 764 5
134.91 715 6
132.74 756 7
130.73 780 8
126.61 732 9
124.07 699 10
122.48 707 11
119.53 756 12
117.69 748 13
111.93 748 14
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : KBr disc
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Spectral Code: Raman : 4880 A,200 M,powder