| SpectraBase Spectrum ID |
743lYCLt8a8 |
| Name |
Dimethylmalonic acid, 4-acetylphenyl undecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.256274254 u |
| Formula |
C24H36O5 |
| InChI |
InChI=1S/C24H36O5/c1-5-6-7-8-9-10-11-12-13-18-28-22(26)24(3,4)23(27)29-21-16-14-20(15-17-21)19(2)25/h14-17H,5-13,18H2,1-4H3 |
| InChIKey |
LLIAVONMTPUTQN-UHFFFAOYSA-N |
| Molecular Weight |
404.547 g/mol |
| SMILES |
CC(C1=CC=C(C=C1)OC(C(C(OCCCCCCCCCCC)=O)(C)C)=O)=O |
