| SpectraBase Spectrum ID |
9NowmxJnuax |
| Name |
2',4'-bis(Decyloxy)acetophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.360345403 u |
| Formula |
C28H48O3 |
| InChI |
InChI=1S/C28H48O3/c1-4-6-8-10-12-14-16-18-22-30-26-20-21-27(25(3)29)28(24-26)31-23-19-17-15-13-11-9-7-5-2/h20-21,24H,4-19,22-23H2,1-3H3 |
| InChIKey |
KDKJLZBGNQGYGA-UHFFFAOYSA-N |
| Molecular Weight |
432.689 g/mol |
| SMILES |
C=1C(=CC(=C(C1)C(C)=O)OCCCCCCCCCC)OCCCCCCCCCC |
| Spectrum/Structure Validation Score (Raman) |
0.978449 |
