| SpectraBase Spectrum ID |
9vK345HkiVp |
| Name |
2-Propanone, 1-(3,4-dimethoxyphenyl)-1-methoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
224.104858991 u |
| Formula |
C12H16O4 |
| InChI |
InChI=1S/C12H16O4/c1-8(13)12(16-4)9-5-6-10(14-2)11(7-9)15-3/h5-7,12H,1-4H3 |
| InChIKey |
NXJDTONJHZCTFS-UHFFFAOYSA-N |
| Molecular Weight |
224.256 g/mol |
| SMILES |
C=1(C=C(OC)C(=CC1)OC)C(C(=O)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964541 |
