| SpectraBase Spectrum ID |
Co6p7HYQMNC |
| Name |
Diethylmalonic acid, 2-ethylphenyl octadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
516.417860279 u |
| Formula |
C33H56O4 |
| InChI |
InChI=1S/C33H56O4/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28-36-31(34)33(7-3,8-4)32(35)37-30-27-24-23-26-29(30)6-2/h23-24,26-27H,5-22,25,28H2,1-4H3 |
| InChIKey |
LKFQDRBIRGPFFN-UHFFFAOYSA-N |
| Molecular Weight |
516.807 g/mol |
| SMILES |
CCC(C(OCCCCCCCCCCCCCCCCCC)=O)(C(OC1=C(C=CC=C1)CC)=O)CC |
