| SpectraBase Spectrum ID |
8mcNztr4EQm |
| Name |
Adipic acid, di(2-phenylethyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.183109313 u |
| Formula |
C22H26O4 |
| InChI |
InChI=1S/C22H26O4/c23-21(25-17-15-19-9-3-1-4-10-19)13-7-8-14-22(24)26-18-16-20-11-5-2-6-12-20/h1-6,9-12H,7-8,13-18H2 |
| InChIKey |
SQRPIABVZLDTIX-UHFFFAOYSA-N |
| Molecular Weight |
354.446 g/mol |
| SMILES |
C(=O)(CCCCC(OCCC1=CC=CC=C1)=O)OCCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971136 |
