| SpectraBase Spectrum ID |
1ThFAuyLzpM |
| Name |
Sebacic acid, dibenzyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.214409442 u |
| Formula |
C24H30O4 |
| InChI |
InChI=1S/C24H30O4/c25-23(27-19-21-13-7-5-8-14-21)17-11-3-1-2-4-12-18-24(26)28-20-22-15-9-6-10-16-22/h5-10,13-16H,1-4,11-12,17-20H2 |
| InChIKey |
DVLXEVMGHXWBOZ-UHFFFAOYSA-N |
| Molecular Weight |
382.500 g/mol |
| SMILES |
C=1C(=CC=CC1)COC(=O)CCCCCCCCC(OCC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Raman) |
0.95102 |
