| SpectraBase Compound ID | A76qJHZVVF4 |
|---|---|
| InChI | InChI=1S/C9H14O4/c1-3-6-5-7(9(11)13-6)8(10)12-4-2/h6-7H,3-5H2,1-2H3 |
| InChIKey | POSFNMSIVMVLRQ-UHFFFAOYSA-N |
| Mol Weight | 186.21 g/mol |
| Molecular Formula | C9H14O4 |
| Exact Mass | 186.089209 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3gbkM6Ei4HF |
|---|---|
| Name | 5-Ethyl-2-oxotetrahydro-3-furoic acid, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.089208927 u |
| Formula | C9H14O4 |
| InChI | InChI=1S/C9H14O4/c1-3-6-5-7(9(11)13-6)8(10)12-4-2/h6-7H,3-5H2,1-2H3 |
| InChIKey | POSFNMSIVMVLRQ-UHFFFAOYSA-N |
| Molecular Weight | 186.207 g/mol |
| SMILES | CCOC(C1C(OC(C1)CC)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.975926 |