| SpectraBase Spectrum ID |
InSiYqKq9Rf |
| Name |
1,9-Diphenylnonane-1,9-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.177630011 u |
| Formula |
C21H24O2 |
| InChI |
InChI=1S/C21H24O2/c22-20(18-12-6-4-7-13-18)16-10-2-1-3-11-17-21(23)19-14-8-5-9-15-19/h4-9,12-15H,1-3,10-11,16-17H2 |
| InChIKey |
DUOQTWGXFNYLIE-UHFFFAOYSA-N |
| Molecular Weight |
308.421 g/mol |
| SMILES |
C(=O)(C=1C=CC=CC1)CCCCCCCC(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893254 |
