TETRAPHENYLENE, 95
Product Name
TETRAPHENYLENE, 95
CAS212-74-8
MFC24H16
MW304.38
InChIInChI=1S/C24H16/c1-2-10-18-17(9-1)19-11-3-4-13-21(19)23-15-7-8-16-24(23)22-14-6-5-12-20(18)22/h1-16H/b19-17-,20-18-,23-21-,24-22-
InChIKeyKTQYWNARBMKMCX-LEYBOLSUSA-N
SmilesC1=C2C(C3C(C4C(C5C2=CC=CC=5)=CC=CC=4)=CC=CC=3)=CC=C1
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Parameter ppm Hz
D(A) 7.119
D(B) 6.994
J(A,A') 7.47
J(A,B) 7.64
J(A,B') 1.35
J(A',B) 1.35
J(A',B') 7.64
J(B,B') 0.55
ERNST,L. ET AL. ORG.MAGN.RESON. 5, 125 (1973)
Spectral Code: 1H NMR : parameter in CS2
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Spectral Code: ESR : ANION RADICAL, RED. WITH K IN THF/DME(2:1), -90C
