2,3',5-三氯联苯(38444-81-4)核磁图(1HNMR)
InChI:InChI=1S/C12H7Cl3/c13-9-3-1-2-8(6-9)11-7-10(14)4-5-12(11)15/h1-7H
InChIKey: ONNCPBRWFSKDMQ-UHFFFAOYSA-N
Smiles:C1(C2=CC=CC(Cl)=C2)=CC(Cl)=CC=C1Cl
-
Parameter ppm Hz
D(A) 7.387
D(B) 7.264
D(C) 7.310
J(A,B) 8.57
J(A,C) 0.34
J(B,C) 2.56
D(D) 7.404
D(E) 7.368
D(F) 7.354
D(G) 7.289
J(D,E) 2.12
J(D,F) 0.45
J(D,G) 1.69
J(E,F) 8.08
J(E,G) 1.03
J(F,G) 7.73
YANAGISAWA,M. ET AL. MAGN.RESON.CHEM. 25, 184 (1987)
Spectral Code: 1H NMR : parameter in CDCl3
-
ppm Int. Assign.
140.33 221 1
139.57 286 2
133.91 227 3
132.49 301 4
130.79 890 5 *
130.69 997 6 *
130.54 243 7
129.11 923 8
129.08 999 9
128.65 909 10
127.94 1000 11
127.16 850 12
Spectral Code: 13C NMR : in CDCl3