| SpectraBase Spectrum ID |
IZi7XSKJzVB |
| Name |
2,4-Dihydroxy-6-(2-keto-2-methoxy-ethyl)benzoic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.063388100 u |
| Formula |
C11H12O6 |
| InChI |
InChI=1S/C11H12O6/c1-16-9(14)4-6-3-7(12)5-8(13)10(6)11(15)17-2/h3,5,12-13H,4H2,1-2H3 |
| InChIKey |
FFWAFVSNRPZNGT-UHFFFAOYSA-N |
| Molecular Weight |
240.211 g/mol |
| SMILES |
C1(=C(CC(=O)OC)C=C(C=C1O)O)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913713 |
