METHYLPHTHALYL ETHYL GLYCOLATE(85-71-2) Raman
Product NameMETHYLPHTHALYL ETHYL GLYCOLATE
CAS85-71-2
Molecular FormulaC13H14O6
Molecular Weight266.25
InChIInChI=1S/C13H14O6/c1-3-18-11(14)8-19-13(16)10-7-5-4-6-9(10)12(15)17-2/h4-7H,3,8H2,1-2H3
InChIKey OYMDOVKIWFMTAW-UHFFFAOYSA-N
SmilesC1(C(OCC(OCC)=O)=O)=CC=CC=C1C(OC)=O
-
Assign. Shift(ppm)
A 7.78 B 7.57 C 4.83 D 4.26 E 3.895 F 1.301Spectral Code: 1H NMR : 90 MHz in CDCl3
-
ppm Int. Assign.
167.73 223 1 * 167.48 274 2 * 166.85 279 3 * 132.01 514 4 # 131.52 670 5 # 131.27 1000 6 7 129.27 670 8 *1 129.03 732 9 *1 61.66 670 10 #1 61.50 821 11 #1 52.65 698 12 14.10 458 13Spectral Code: 13C NMR : in CDCl3
-
Spectral Code: IR : liquid film
-
Spectral Code: Raman : 4880 A,200 M,liquid