| SpectraBase Spectrum ID |
KXZHvDWYgVa |
| Name |
1-(3,4-Dimethoxyphenyl)decan-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
292.203844759 u |
| Formula |
C18H28O3 |
| InChI |
InChI=1S/C18H28O3/c1-4-5-6-7-8-9-16(19)12-10-15-11-13-17(20-2)18(14-15)21-3/h11,13-14H,4-10,12H2,1-3H3 |
| InChIKey |
WPGKEQMMTRTWDF-UHFFFAOYSA-N |
| Molecular Weight |
292.419 g/mol |
| SMILES |
C(CC(CCCCCCC)=O)C1=CC(=C(C=C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921356 |
