Diphenyl suberate
Product Name
Diphenyl suberate
CAS16868-07-8
MF
MW
InChIInChI=1S/C20H22O4/c21-19(23-17-11-5-3-6-12-17)15-9-1-2-10-16-20(22)24-18-13-7-4-8-14-18/h3-8,11-14H,1-2,9-10,15-16H2
InChIKeyNOPGQWZBTYTFAP-UHFFFAOYSA-N
SmilesC(OC1=CC=CC=C1)(=O)CCCCCCC(OC1=CC=CC=C1)=O
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Assign. Shift(ppm)
A 7.371
B 7.221
C 7.078
D 2.574
E 1.793
F 1.492
Spectral Code: 1H NMR : 400 MHz in CDCl3
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ppm Int. Assign.
171.98 59 1
150.96 64 2
129.41 846 3
125.71 526 4
121.60 1000 5
34.37 533 6
28.78 595 7
24.81 603 8
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : nujol mull
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Spectral Code: Raman : 4880 A,200 M,powder
Diphenyl suberate(16868-07-8)Raman Atlas of Related Products