| SpectraBase Compound ID | JesYMT0Mz1B |
|---|---|
| InChI | InChI=1S/C11H18O2/c1-3-13-11(12)9(2)10-7-5-4-6-8-10/h7,9H,3-6,8H2,1-2H3 |
| InChIKey | BFZNPOSUGATSAL-UHFFFAOYSA-N |
| Mol Weight | 182.26 g/mol |
| Molecular Formula | C11H18O2 |
| Exact Mass | 182.13068 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CX2lG5fTHK1 |
|---|---|
| Name | Ethyl 2-cyclohex-1'-en-1'-yl-propanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.130679818 u |
| Formula | C11H18O2 |
| InChI | InChI=1S/C11H18O2/c1-3-13-11(12)9(2)10-7-5-4-6-8-10/h7,9H,3-6,8H2,1-2H3 |
| InChIKey | BFZNPOSUGATSAL-UHFFFAOYSA-N |
| Molecular Weight | 182.263 g/mol |
| SMILES | C(C(C1=CCCCC1)C)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.983419 |