| SpectraBase Spectrum ID |
HONsugioUTC |
| Name |
Ethyl 4-hydroxy-6-methyl-2-oxo-3-cyclohexene-1-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
198.089208927 u |
| Formula |
C10H14O4 |
| InChI |
InChI=1S/C10H14O4/c1-3-14-10(13)9-6(2)4-7(11)5-8(9)12/h5-6,9,11H,3-4H2,1-2H3 |
| InChIKey |
GABAYOQGPJPKDK-UHFFFAOYSA-N |
| Molecular Weight |
198.218 g/mol |
| SMILES |
C1(O)=CC(C(C(C1)C)C(=O)OCC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.707159 |
