bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate (84-71-9) 13C NMR
Product Namebis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate
CAS84-71-9
Molecular FormulaC24H44O4
Molecular Weight396.6
InChIInChI=1S/C24H44O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h19-22H,5-18H2,1-4H3
InChIKey DIMOQAGSNHTROK-UHFFFAOYSA-N
SmilesC1(C(OCC(CC)CCCC)=O)CCCCC1C(OCC(CC)CCCC)=O
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Assign. Shift(ppm)
A 3.99 B 2.82 C 2.02 D 1.79 E 1.54 F 1.49 G 1.41 J 1.35 K 1.30 L 1.28 M 0.892 N 0.882Spectral Code: 1H NMR : 400 MHz in CDCl3
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ppm Int. Assign.
173.76 425 1 66.74 597 2 42.81 586 3 38.90 640 4 30.55 570 5 * 29.04 602 6 * 26.50 468 7 23.95 1000 8 9 # 23.05 645 10 # 14.06 591 11 11.02 586 12Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film
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Spectral Code: Raman : 4880 A,200 M,liquid
