2,2',5-三氯聯(lián)苯醚(37680-65-2)核磁圖(1HNMR)
InChI:InChI=1S/C12H7Cl3/c13-8-5-6-12(15)10(7-8)9-3-1-2-4-11(9)14/h1-7H
InChIKey: DCMURXAZTZQAFB-UHFFFAOYSA-N
Smiles:C1(C2=CC=CC=C2Cl)=CC(Cl)=CC=C1Cl
-

Parameter ppm Hz
D(A) 7.390
D(B) 7.317
D(C) 7.269
J(A,B) 8.54
J(A,C) 0.45
J(B,C) 2.60
D(D) 7.470
D(E) 7.334
D(F) 7.311
D(G) 7.234
J(D,E) 8.10
J(D,F) 1.20
J(D,G) 0.43
J(E,F) 7.48
J(E,G) 1.67
J(F,G) 7.65
YANAGISAWA,M. ET AL. MAGN.RESON.CHEM. 25, 184 (1987)
Spectral Code: 1H NMR : parameter in CDCl3
-

ppm Int. Assign.
139.55 151 1
136.98 159 2
133.17 152 3
132.06 173 4
131.77 141 5
130.80 518 6 *
130.64 505 7 *
130.20 515 8 *
129.27 1000 9
10
128.90 532 11
126.25 509 12
Spectral Code: 13C NMR : in CDCl3