| SpectraBase Compound ID | E1VdJkS2TKy |
|---|---|
| InChI | InChI=1S/C7H14O2/c1-4-6(5-2)7(8)9-3/h6H,4-5H2,1-3H3 |
| InChIKey | UNEAEGWIVFZPFI-UHFFFAOYSA-N |
| Mol Weight | 130.19 g/mol |
| Molecular Formula | C7H14O2 |
| Exact Mass | 130.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LBeI5Q2ipto |
|---|---|
| Name | Butanoic acid, 2-ethyl-, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.099379689 u |
| Formula | C7H14O2 |
| InChI | InChI=1S/C7H14O2/c1-4-6(5-2)7(8)9-3/h6H,4-5H2,1-3H3 |
| InChIKey | UNEAEGWIVFZPFI-UHFFFAOYSA-N |
| Molecular Weight | 130.187 g/mol |
| SMILES | C(C(CC)CC)(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.983468 |