Glyceryl tri(2-ethylhexanoate)(7360-38-5) 1H NMR
Product NameGlyceryl tri(2-ethylhexanoate)
CAS7360-38-5
Molecular FormulaC27H50O6
Molecular Weight470.68
InChIInChI=1S/C27H50O6/c1-7-13-16-21(10-4)25(28)31-19-24(33-27(30)23(12-6)18-15-9-3)20-32-26(29)22(11-5)17-14-8-2/h21-24H,7-20H2,1-6H3
InChIKey DGSZGZSCHSQXFV-UHFFFAOYSA-N
SmilesC(OC(=O)C(CC)CCCC)C(OC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC
-
Assign. Shift(ppm)
A 5.296 B *1 4.361 C *1 4.139 D 2.282 E 1.69 to 1.400 F 1.39 to 1.170 G 0.92 to 0.860 J(B,C)=11.9HZ.Spectral Code: 1H NMR : 400 MHz in CDCl3
-
ppm Int. Assign.
175.72 481 1 175.28 208 2 69.08 274 3 62.16 551 4 47.30 384 5 47.24 704 6 31.59 676 7 8 29.61 557 9 10 25.37 724 11 12 22.66 923 13 14 13.90 1000 15 16 11.80 802 17 18Spectral Code: 13C NMR : in CDCl3
-
Spectral Code: IR : liquid film
