| SpectraBase Spectrum ID |
JupnHcUYSnx |
| Name |
Gallacetophenone-4'-methylether, diacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.079038165 u |
| Formula |
C13H14O6 |
| InChI |
InChI=1S/C13H14O6/c1-7(14)10-5-6-11(17-4)13(19-9(3)16)12(10)18-8(2)15/h5-6H,1-4H3 |
| InChIKey |
GOYBUMLAFMDMCA-UHFFFAOYSA-N |
| Molecular Weight |
266.249 g/mol |
| SMILES |
C(C)(=O)C1=C(OC(C)=O)C(OC(C)=O)=C(C=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937479 |
