| SpectraBase Spectrum ID |
DVAoi2xoNka |
| Name |
2-(Acetoxy)-4,6-dimethoxy-acetophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.084123546 u |
| Formula |
C12H14O5 |
| InChI |
InChI=1S/C12H14O5/c1-7(13)12-10(16-4)5-9(15-3)6-11(12)17-8(2)14/h5-6H,1-4H3 |
| InChIKey |
RBIJJTIPYJFRLT-UHFFFAOYSA-N |
| Molecular Weight |
238.239 g/mol |
| SMILES |
C=1C(=CC(=C(C1OC(=O)C)C(C)=O)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962432 |