4-(4-ETHOXYPHENOXYCARBONYL)PHENYL PENTYL CARBONATE(33926-46-4) MS
Product Name4-(4-ETHOXYPHENOXYCARBONYL)PHENYL PENTYL CARBONATE
CAS33926-46-4
Molecular FormulaC21H24O6
Molecular Weight372.41
InChIInChI=1S/C21H24O6/c1-3-5-6-15-25-21(23)27-19-9-7-16(8-10-19)20(22)26-18-13-11-17(12-14-18)24-4-2/h7-14H,3-6,15H2,1-2H3
InChIKey QVUSHDHMLLZBDM-UHFFFAOYSA-N
SmilesC(OC1=CC=C(OCC)C=C1)(=O)C1=CC=C(OC(OCCCCC)=O)C=C1
-
Assign. Shift(ppm)
A 8.22 B 7.32 C 7.10 D 6.93 E 4.27 F 4.03 G 1.77 J 1.58 to 1.16 K 1.416 L 0.94Spectral Code: 1H NMR : 90 MHz in CDCl3
-
ppm Int. Assign.
164.65 209 1 156.82 433 2 155.11 408 3 153.03 308 4 144.28 368 5 131.81 1000 6 127.36 378 7 122.38 990 8 121.21 886 9 115.18 935 10 69.35 373 11 63.89 393 12 28.28 443 13 * 27.83 468 14 * 22.29 473 15 14.83 328 16 13.91 373 17Spectral Code: 13C NMR : in CDCl3
-
Spectral Code: IR : nujol mull