| SpectraBase Spectrum ID |
K1nGDTFsJ1E |
| Name |
5-(Ethoxymethyl)-2,3-dimethoxy-1,4-benzoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.084123546 u |
| Formula |
C11H14O5 |
| InChI |
InChI=1S/C11H14O5/c1-4-16-6-7-5-8(12)10(14-2)11(15-3)9(7)13/h5H,4,6H2,1-3H3 |
| InChIKey |
ZHTRLFJHCFWMPR-UHFFFAOYSA-N |
| Molecular Weight |
226.228 g/mol |
| SMILES |
C1(C(=C(C(C(=C1)COCC)=O)OC)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927872 |
