| SpectraBase Spectrum ID |
HlG0Js7pBXh |
| Name |
Diethylmalonic acid, 3-ethylphenyl hexadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
488.386560150 u |
| Formula |
C31H52O4 |
| InChI |
InChI=1S/C31H52O4/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-25-34-29(32)31(7-3,8-4)30(33)35-28-24-22-23-27(6-2)26-28/h22-24,26H,5-21,25H2,1-4H3 |
| InChIKey |
LTERDCIDQIXPMJ-UHFFFAOYSA-N |
| Molecular Weight |
488.753 g/mol |
| SMILES |
CCC1=CC=CC(=C1)OC(C(C(OCCCCCCCCCCCCCCCC)=O)(CC)CC)=O |
