| SpectraBase Spectrum ID |
DjPWlJZgaBJ |
| Name |
Benzoic acid, 4-(acetyloxy)-, 4-[(4-pentylphenoxy)carbonyl]phenyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
446.172938551 u |
| Formula |
C27H26O6 |
| InChI |
InChI=1S/C27H26O6/c1-3-4-5-6-20-7-13-24(14-8-20)32-26(29)22-11-17-25(18-12-22)33-27(30)21-9-15-23(16-10-21)31-19(2)28/h7-18H,3-6H2,1-2H3 |
| InChIKey |
JNTZRWGGOSTEAX-UHFFFAOYSA-N |
| Molecular Weight |
446.499 g/mol |
| SMILES |
CCCCCC1=CC=C(C=C1)OC(=O)C1=CC=C(C=C1)OC(=O)C1=CC=C(C=C1)OC(C)=O |
![Benzoic acid, 4-(acetyloxy)-, 4-[(4-pentylphenoxy)carbonyl]phenyl ester](/api/spectrum/DjPWlJZgaBJ/structure.png?h=300&w=458 "Benzoic acid, 4-(acetyloxy)-, 4-[(4-pentylphenoxy)carbonyl]phenyl ester")
